data_2nbd_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 2nbd _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt . . . . . 0 C--O 1.23 0.065 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.559 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.559 ' H ' ' HG1' ' A' ' 9' ' ' THR . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.518 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.519 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.518 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.453 ' CZ ' HE22 ' A' ' 49' ' ' GLN . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.52 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.453 HE22 ' CZ ' ' A' ' 42' ' ' ARG . 20.5 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.565 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.488 ' N ' ' ND1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt . . . . . 0 C--O 1.231 0.085 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.534 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.534 ' H ' ' HG1' ' A' ' 9' ' ' THR . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.436 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.608 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.52 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.621 ' HG1' ' H ' ' A' ' 9' ' ' THR . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.621 ' H ' ' HG1' ' A' ' 7' ' ' THR . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.582 ' H ' ' HG1' ' A' ' 9' ' ' THR . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.587 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.525 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.519 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.525 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.611 ' NE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.501 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.611 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.425 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.231 0.124 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.612 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.408 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.231 0.088 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.506 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.506 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.55 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 21' ' ' ASP . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.55 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.595 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.412 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' N ' ' CD2' ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.515 ' OD1' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt . . . . . 0 N--CA 1.461 0.116 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.62 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.405 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.523 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.516 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.526 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 47.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.461 0.118 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.562 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.562 ' H ' ' HG1' ' A' ' 9' ' ' THR . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.611 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.422 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.675 ' HG1' ' HG ' ' A' ' 57' ' ' SER . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.675 ' HG ' ' HG1' ' A' ' 55' ' ' THR . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.431 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.605 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.413 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.1 m-80 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.4 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.456 ' HZ3' ' CB ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.9 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.57 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.613 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.497 ' C ' ' HZ3' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.497 ' HZ3' ' C ' ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.426 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.416 ' NE ' ' NE2' ' A' ' 49' ' ' GLN . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 54.5 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.6 pt . . . . . 0 C--O 1.231 0.1 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.496 ' CB ' ' HZ3' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.525 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.525 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.606 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.414 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.518 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.492 ' HG1' ' H ' ' A' ' 58' ' ' ASP . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.492 ' H ' ' HG1' ' A' ' 55' ' ' THR . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.417 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.5 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.2 mt . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.52 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.537 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.446 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.537 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.607 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.417 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.523 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.401 ' OG1' ' OD2' ' A' ' 58' ' ' ASP . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt . . . . . 0 N--CA 1.463 0.186 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.423 ' C ' ' H ' ' A' ' 11' ' ' LYS . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 9' ' ' THR . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' ASP . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.597 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.424 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.523 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.647 ' H ' ' HG ' ' A' ' 65' ' ' SER . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.647 ' HG ' ' H ' ' A' ' 62' ' ' GLN . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.464 0.27 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.652 ' HZ1' ' HG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.652 ' HG1' ' HZ1' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.498 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.616 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.422 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' CD2' ' A' ' 43' ' ' LEU . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.498 ' HG1' ' CG ' ' A' ' 58' ' ' ASP . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.498 ' CG ' ' HG1' ' A' ' 55' ' ' THR . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.43 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.3 pt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.496 ' CD ' ' HG1' ' A' ' 12' ' ' THR . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.496 ' HG1' ' CD ' ' A' ' 6' ' ' LYS . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.446 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.588 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.614 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.655 ' NH1' HE21 ' A' ' 49' ' ' GLN . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.655 HE21 ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.504 ' H ' ' HG ' ' A' ' 65' ' ' SER . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.504 ' HG ' ' H ' ' A' ' 62' ' ' GLN . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.428 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.465 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.696 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.486 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.59 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.624 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.632 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.632 HE22 ' N ' ' A' ' 31' ' ' GLN . 37.1 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.554 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.459 ' HG1' ' CG ' ' A' ' 58' ' ' ASP . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.459 ' CG ' ' HG1' ' A' ' 55' ' ' THR . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.493 ' N ' HD21 ' A' ' 60' ' ' ASN . 1.0 OUTLIER 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.431 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.4 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.232 0.141 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.624 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.576 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.436 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.644 ' HG1' ' HG1' ' A' ' 9' ' ' THR . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.693 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.644 ' HG1' ' HG1' ' A' ' 7' ' ' THR . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.56 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.403 ' C ' ' H ' ' A' ' 21' ' ' ASP . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.56 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.603 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.414 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.525 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.52 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.456 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.474 ' O ' ' CD1' ' A' ' 8' ' ' LEU . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt . . . . . 0 N--CA 1.464 0.236 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.514 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.603 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.449 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.52 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 1.3 m120 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.461 ' HZ3' ' CB ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt . . . . . 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.466 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.584 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.628 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.436 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.5 mpp? . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -169.4 156.77 6.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.733 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt -108.54 172.32 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.559 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.559 ' H ' ' HG1' ' A' ' 9' ' ' THR . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.518 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.519 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.518 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.453 ' CZ ' HE22 ' A' ' 49' ' ' GLN . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.52 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.453 HE22 ' CZ ' ' A' ' 42' ' ' ARG . 20.5 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.565 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.488 ' N ' ' ND1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt -109.55 141.33 42.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -90.83 120.51 31.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.617 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.3 tp -167.85 86.93 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.548 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -98.33 152.38 19.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.667 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.8 -48.96 0.08 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.809 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.913 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.536 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.7 pt20 -168.53 152.12 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.774 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -108.5 172.57 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.534 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.534 ' H ' ' HG1' ' A' ' 9' ' ' THR . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.436 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.608 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.52 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.536 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt -99.66 123.14 43.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -90.69 125.13 35.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.693 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -170.43 96.07 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.65 154.94 20.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.59 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.37 21.47 3.1 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.917 -179.963 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.557 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -153.16 138.48 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.475 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt -107.9 171.44 2.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.621 ' HG1' ' H ' ' A' ' 9' ' ' THR . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.621 ' H ' ' HG1' ' A' ' 7' ' ' THR . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.582 ' H ' ' HG1' ' A' ' 9' ' ' THR . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.587 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.525 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.519 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.525 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.611 ' NE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.501 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.611 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.557 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.425 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt -99.08 126.12 44.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -90.77 129.33 36.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.534 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.99 -178.93 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.623 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -100.46 138.01 38.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.617 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.76 -117.18 4.39 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.757 0 CA-C-O 118.015 -1.436 . . . . 0.0 110.958 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 24.8 mt-30 -138.59 133.96 33.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.403 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt -108.06 171.4 2.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.612 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.408 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.5 HH11 ' NH2' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt -102.06 122.76 44.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.5 ' NH2' HH11 ' A' ' 42' ' ' ARG . 3.4 tmm_? -93.93 127.33 39.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.564 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -169.61 70.51 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.586 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.63 129.27 32.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -97.86 49.85 1.4 Allowed Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.832 0 CA-C-O 118.025 -1.43 . . . . 0.0 110.94 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.588 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 63' ' ' LYS . 2.1 pt20 -167.45 149.86 5.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.89 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -108.54 167.04 4.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.506 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.55 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 21' ' ' ASP . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.55 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.595 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.412 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' N ' ' CD2' ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.515 ' OD1' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -99.98 116.22 31.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -91.38 139.75 30.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -167.51 98.76 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.536 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.35 154.94 42.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.503 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.68 101.28 0.62 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.695 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.972 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.526 ' O ' ' O ' ' A' ' 63' ' ' LYS . 12.8 pt20 -161.59 150.15 15.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.6 166.59 4.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.62 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.405 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.523 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.516 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.526 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.526 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 47.2 mt -99.58 141.47 32.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -98.3 117.28 32.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.558 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.77 105.27 0.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.504 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 -142.48 140.34 31.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 156.64 38.68 0.02 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.808 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.441 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.8 mpp? . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.8 pt20 -147.29 132.41 18.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.66 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -108.37 163.43 5.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.562 ' HG1' ' H ' ' A' ' 11' ' ' LYS . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.562 ' H ' ' HG1' ' A' ' 9' ' ' THR . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.611 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.422 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.675 ' HG1' ' HG ' ' A' ' 57' ' ' SER . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.675 ' HG ' ' HG1' ' A' ' 55' ' ' THR . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt -99.55 124.7 44.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -91.05 127.73 36.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.375 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mt -160.59 102.16 1.35 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -146.13 125.5 13.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -44.68 -86.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.075 -1.403 . . . . 0.0 111.019 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 3.2 pt20 -160.84 150.43 17.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.602 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt -108.59 172.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.431 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.605 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.413 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.1 m-80 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.4 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.456 ' HZ3' ' CB ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt -99.57 126.92 45.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.433 ' NH2' ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -93.38 115.35 27.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.522 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.433 ' C ' ' NH2' ' A' ' 72' ' ' ARG . 58.1 mt -118.87 129.95 55.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.519 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -101.63 142.63 32.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.519 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.43 23.03 71.71 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.786 0 CA-C-O 117.965 -1.464 . . . . 0.0 110.968 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.511 ' O ' ' O ' ' A' ' 63' ' ' LYS . 2.3 pt20 -171.22 150.9 3.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.9 pt -108.82 172.56 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.57 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.613 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.497 ' C ' ' HZ3' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.497 ' HZ3' ' C ' ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.426 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.416 ' NE ' ' NE2' ' A' ' 49' ' ' GLN . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 54.5 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.511 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mt -99.76 137.22 38.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttt85 -90.7 125.05 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.532 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.27 108.62 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.593 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -102.9 125.92 49.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.547 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 152.34 116.29 0.67 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.704 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.912 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.55 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -163.66 150.53 12.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.455 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.6 pt -108.16 172.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' CB ' ' HZ3' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.525 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.525 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.606 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.414 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.518 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.617 ' CZ ' HH22 ' A' ' 72' ' ' ARG . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.492 ' HG1' ' H ' ' A' ' 58' ' ' ASP . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.492 ' H ' ' HG1' ' A' ' 55' ' ' THR . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.417 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.5 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.55 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.2 mt -100.65 129.05 46.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.617 HH22 ' CZ ' ' A' ' 42' ' ' ARG . 14.3 ttt85 -101.77 157.23 16.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.484 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 72' ' ' ARG . 3.9 mp 56.19 113.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.711 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -136.46 154.01 50.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.528 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.57 -60.05 2.04 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.77 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.92 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtp . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.7 mm-40 -48.07 158.01 0.26 Allowed 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.61 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt -150.68 172.83 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.52 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.475 ' C ' ' NE2' ' A' ' 2' ' ' GLN . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.537 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.446 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.537 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.607 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.417 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.523 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.401 ' OG1' ' OD2' ' A' ' 58' ' ' ASP . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt -109.42 123.11 48.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -90.47 126.7 35.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.736 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.38 -177.32 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -126.1 143.69 51.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.504 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.17 158.17 27.59 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.053 -1.415 . . . . 0.0 110.92 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.3 mt-30 -45.79 159.95 0.06 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.571 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt -150.59 173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.423 ' C ' ' H ' ' A' ' 11' ' ' LYS . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 9' ' ' THR . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' ASP . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.597 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.424 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.523 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.647 ' H ' ' HG ' ' A' ' 65' ' ' SER . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLN . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.647 ' HG ' ' H ' ' A' ' 62' ' ' GLN . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt -99.35 133.99 42.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.83 131.27 36.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.19 122.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -140.21 132.56 28.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.37 -23.53 0.24 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.78 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.934 -179.986 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mtt . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.8 pt20 -69.41 165.32 21.08 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.651 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -147.07 173.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.652 ' HZ1' ' HG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.652 ' HG1' ' HZ1' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.498 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.616 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.422 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' CD2' ' A' ' 43' ' ' LEU . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.498 ' HG1' ' CG ' ' A' ' 58' ' ' ASP . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.498 ' CG ' ' HG1' ' A' ' 55' ' ' THR . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.43 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt -103.06 114.27 28.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -90.63 115.32 27.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.615 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tt -168.38 54.52 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.369 0.604 . . . . 0.0 110.373 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -140.58 152.19 45.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.614 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -98.02 -57.65 1.01 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.737 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.923 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.561 ' O ' ' O ' ' A' ' 63' ' ' LYS . 28.7 tt0 64.87 82.82 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.23 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.3 pt -107.91 172.49 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' CD ' ' HG1' ' A' ' 12' ' ' THR . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.496 ' HG1' ' CD ' ' A' ' 6' ' ' LYS . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.446 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.588 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.614 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.655 ' NH1' HE21 ' A' ' 49' ' ' GLN . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.655 HE21 ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.504 ' H ' ' HG ' ' A' ' 65' ' ' SER . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 2' ' ' GLN . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.504 ' HG ' ' H ' ' A' ' 62' ' ' GLN . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.428 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.465 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.8 mt -104.39 140.76 37.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -90.57 144.01 26.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.41 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.15 138.73 7.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -131.01 128.03 39.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.534 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.8 -33.13 86.43 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.715 0 CA-C-O 118.045 -1.419 . . . . 0.0 110.971 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.556 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.49 135.63 38.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.568 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt -107.79 172.51 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.696 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.486 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.59 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.624 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.632 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.632 HE22 ' N ' ' A' ' 31' ' ' GLN . 37.1 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.554 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.459 ' HG1' ' CG ' ' A' ' 58' ' ' ASP . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.459 ' CG ' ' HG1' ' A' ' 55' ' ' THR . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt -99.34 143.75 29.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.98 154.33 47.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.882 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.5 mt 56.73 97.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.478 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -106.81 137.49 44.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.548 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.6 -61.34 6.33 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.733 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.879 -179.894 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.471 ' O ' ' CB ' ' A' ' 2' ' ' GLN . 10.2 ttm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.575 ' O ' ' O ' ' A' ' 63' ' ' LYS . 20.6 tt0 81.47 80.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.9 pt -108.42 171.63 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.622 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.493 ' N ' HD21 ' A' ' 60' ' ' ASN . 1.0 OUTLIER 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.575 ' O ' ' O ' ' A' ' 2' ' ' GLN . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.431 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.4 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mt -106.55 115.7 30.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.0 tmm_? -93.25 124.97 37.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.354 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 tt -148.22 99.38 3.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.582 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.7 mtp85 -105.25 129.14 53.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.482 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 55.6 -142.87 36.49 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.724 0 CA-C-O 117.932 -1.482 . . . . 0.0 111.013 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.551 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -129.57 136.09 49.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.353 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -107.88 172.14 2.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.589 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.624 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.726 ' HE ' ' HE ' ' A' ' 72' ' ' ARG . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.576 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.551 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.436 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -99.94 114.52 27.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.726 ' HE ' ' HE ' ' A' ' 42' ' ' ARG . 10.0 ttm180 -103.5 142.03 34.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.388 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.94 107.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.559 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -101.95 137.05 40.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.574 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 162.0 -62.41 0.28 Allowed Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.924 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.579 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.2 mpp? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.532 ' O ' ' O ' ' A' ' 63' ' ' LYS . 8.9 pt20 -171.1 148.7 2.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.762 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.75 172.44 2.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.644 ' HG1' ' HG1' ' A' ' 9' ' ' THR . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.693 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.644 ' HG1' ' HG1' ' A' ' 7' ' ' THR . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.56 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.403 ' C ' ' H ' ' A' ' 21' ' ' ASP . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.56 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.603 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.414 ' C ' ' O ' ' A' ' 22' ' ' THR . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.525 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.52 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.586 HH11 ' NE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.456 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.474 ' O ' ' CD1' ' A' ' 8' ' ' LEU . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt -100.95 143.81 30.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.586 ' NE ' HH11 ' A' ' 42' ' ' ARG . 0.9 OUTLIER -93.91 120.27 33.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.506 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.38 101.46 3.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.46 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.22 141.87 51.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.631 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.7 -20.05 25.42 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.785 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.982 -179.973 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtp . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.5 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.6 mt-30 -96.38 164.17 12.75 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt -150.5 173.72 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.514 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.603 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' C ' ' O ' ' A' ' 22' ' ' THR . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.449 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.52 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 1.3 m120 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.5 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt -100.45 127.04 46.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -91.58 114.63 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.559 ' CD1' ' N ' ' A' ' 73' ' ' LEU . 5.1 mp -95.87 165.37 12.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.481 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -102.81 154.12 19.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.619 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.82 -125.99 1.0 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.649 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.904 -179.959 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.586 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.538 ' O ' ' O ' ' A' ' 63' ' ' LYS . 5.7 pt20 -164.69 151.27 10.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.564 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt -108.21 172.76 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.466 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.584 ' O ' ' N ' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.628 ' CD1' ' H ' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.436 ' N ' ' CD ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.538 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt -99.86 121.24 41.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -94.01 125.74 38.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.599 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 tt -162.36 101.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.14 134.06 29.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.567 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -86.22 -44.6 5.88 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.73 0 CA-C-O 117.973 -1.459 . . . . 0.0 110.958 179.97 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt . . . . . 0 C--O 1.23 0.065 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.876 ' O ' HD23 ' A' ' 15' ' ' LEU . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.876 HD23 ' O ' ' A' ' 14' ' ' THR . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.479 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.646 ' C ' HD12 ' A' ' 44' ' ' ILE . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.646 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.549 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.47 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.565 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 61' ' ' ILE . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.554 HG21 HD22 ' A' ' 56' ' ' LEU . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.488 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.46 HD12 ' CD1' ' A' ' 67' ' ' LEU . 9.0 pt . . . . . 0 C--O 1.231 0.085 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.568 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.494 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 44' ' ' ILE . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.623 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 22' ' ' THR . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 61' ' ' ILE . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 56' ' ' LEU . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.46 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.896 ' O ' HD23 ' A' ' 15' ' ' LEU . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.703 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.495 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.621 ' HE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 44' ' ' ILE . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.63 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.509 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.478 HD22 HG21 ' A' ' 61' ' ' ILE . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HD22 ' A' ' 56' ' ' LEU . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.643 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.624 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.231 0.124 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.549 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 38' ' ' PRO . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 44' ' ' ILE . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 22' ' ' THR . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.231 0.088 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.426 HG22 ' HB2' ' A' ' 67' ' ' LEU . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HZ2' HG21 ' A' ' 66' ' ' THR . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.575 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.575 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.46 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.458 HE22 ' N ' ' A' ' 31' ' ' GLN . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.514 ' N ' HD22 ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.515 ' N ' ' OD1' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 22' ' ' THR . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.566 HD22 HG21 ' A' ' 61' ' ' ILE . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.566 HG21 HD22 ' A' ' 56' ' ' LEU . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.496 HG21 ' HZ2' ' A' ' 6' ' ' LYS . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.426 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt . . . . . 0 N--CA 1.461 0.116 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 67' ' ' LEU . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.891 ' O ' HD23 ' A' ' 15' ' ' LEU . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.548 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.888 HD13 HD21 ' A' ' 71' ' ' LEU . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.548 HE22 ' N ' ' A' ' 31' ' ' GLN . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.41 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG21 HD22 ' A' ' 56' ' ' LEU . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.419 ' O ' HD12 ' A' ' 67' ' ' LEU . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 4' ' ' PHE . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.888 HD21 HD13 ' A' ' 36' ' ' ILE . 47.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.461 0.118 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.527 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.427 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 22' ' ' THR . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 61' ' ' ILE . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.49 HG21 HD22 ' A' ' 56' ' ' LEU . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.638 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.626 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 70' ' ' VAL . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.871 ' O ' HD23 ' A' ' 15' ' ' LEU . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.3 m120 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.518 ' C ' HE22 ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.518 HE22 ' C ' ' A' ' 27' ' ' LYS . 15.1 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 48' ' ' LYS . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 22' ' ' THR . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.447 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.455 HD12 ' CD1' ' A' ' 67' ' ' LEU . 6.9 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.899 ' O ' HD23 ' A' ' 15' ' ' LEU . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.899 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.593 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.802 HG22 ' NZ ' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.802 ' NZ ' HG22 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.438 ' CG2' HD21 ' A' ' 71' ' ' LEU . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.546 ' O ' HD23 ' A' ' 71' ' ' LEU . 6.2 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.478 ' HE ' HD11 ' A' ' 44' ' ' ILE . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 44' ' ' ILE . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 54.5 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 HG21 ' A' ' 61' ' ' ILE . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.462 HG21 HD22 ' A' ' 56' ' ' LEU . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.455 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 40' ' ' GLN . 2.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.462 HD12 ' CD1' ' A' ' 67' ' ' LEU . 13.6 pt . . . . . 0 C--O 1.231 0.1 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.532 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.901 ' O ' HD23 ' A' ' 15' ' ' LEU . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 14' ' ' THR . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.471 HG21 HD21 ' A' ' 71' ' ' LEU . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.601 ' O ' HD23 ' A' ' 71' ' ' LEU . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 44' ' ' ILE . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.638 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 22' ' ' THR . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.431 HD22 HG21 ' A' ' 61' ' ' ILE . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.431 HG21 HD22 ' A' ' 56' ' ' LEU . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 40' ' ' GLN . 12.2 mt . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.533 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.87 ' O ' HD23 ' A' ' 15' ' ' LEU . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.87 HD23 ' O ' ' A' ' 14' ' ' THR . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.559 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.4 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 44' ' ' ILE . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.62 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt . . . . . 0 N--CA 1.463 0.186 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.586 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HZ2' HG22 ' A' ' 23' ' ' ILE . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 22' ' ' THR . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.464 0.27 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG11 HD11 ' A' ' 30' ' ' ILE . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.477 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.477 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.498 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.456 HG22 ' CE ' ' A' ' 27' ' ' LYS . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' CE ' HG22 ' A' ' 23' ' ' ILE . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.447 HD13 HD12 ' A' ' 69' ' ' LEU . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.507 ' O ' HD23 ' A' ' 71' ' ' LEU . 27.6 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' HD22 ' A' ' 43' ' ' LEU . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.648 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.622 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.555 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.3 pt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' A' ' 67' ' ' LEU . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.898 ' O ' HD23 ' A' ' 15' ' ' LEU . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.898 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.694 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.416 ' CG2' HD21 ' A' ' 71' ' ' LEU . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.465 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.591 ' C ' HD12 ' A' ' 44' ' ' ILE . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.3 tt0 -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 22' ' ' THR . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 HG21 ' A' ' 61' ' ' ILE . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.461 HG21 HD22 ' A' ' 56' ' ' LEU . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.555 ' C ' HG22 ' A' ' 3' ' ' ILE . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.431 ' HB2' HG22 ' A' ' 5' ' ' VAL . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.635 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.633 ' N ' HD23 ' A' ' 69' ' ' LEU . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.416 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.444 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.92 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.887 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.887 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.536 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.447 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.536 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.704 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.495 ' NE2' ' O ' ' A' ' 27' ' ' LYS . 11.9 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.554 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.45 HD22 HG21 ' A' ' 61' ' ' ILE . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.45 HG21 HD22 ' A' ' 56' ' ' LEU . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.545 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.9 pt . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.597 ' CG2' HD11 ' A' ' 13' ' ' ILE . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.597 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.878 ' O ' HD23 ' A' ' 15' ' ' LEU . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.69 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.593 ' CG2' HD21 ' A' ' 71' ' ' LEU . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.473 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m120 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' C ' HG22 ' A' ' 3' ' ' ILE . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.639 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.637 ' N ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.593 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.4 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.232 0.141 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.698 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.798 ' O ' HD23 ' A' ' 71' ' ' LEU . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 61' ' ' ILE . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.433 HG21 HD22 ' A' ' 56' ' ' LEU . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.653 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.64 ' N ' HD23 ' A' ' 69' ' ' LEU . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 40' ' ' GLN . 4.7 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.615 ' NZ ' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.89 ' O ' HD23 ' A' ' 15' ' ' LEU . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.89 HD23 ' O ' ' A' ' 14' ' ' THR . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.584 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.514 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 22' ' ' THR . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.42 HD22 HG21 ' A' ' 61' ' ' ILE . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.42 HG21 HD22 ' A' ' 56' ' ' LEU . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.615 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 70' ' ' VAL . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.647 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt . . . . . 0 N--CA 1.464 0.236 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 67' ' ' LEU . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' CB ' ' NZ ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.528 HD22 ' N ' ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.897 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.897 HD23 ' O ' ' A' ' 14' ' ' THR . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.44 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.426 HG21 HD21 ' A' ' 71' ' ' LEU . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.617 ' O ' HD23 ' A' ' 71' ' ' LEU . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.516 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.449 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.479 ' HB2' HG22 ' A' ' 5' ' ' VAL . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt . . . . . 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.453 HG22 ' HB2' ' A' ' 67' ' ' LEU . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.553 HD11 HG13 ' A' ' 70' ' ' VAL . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.873 ' O ' HD23 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.873 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.479 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.41 ' C ' HE22 ' A' ' 41' ' ' GLN . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.473 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.41 HE22 ' C ' ' A' ' 27' ' ' LYS . 26.8 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 43' ' ' LEU . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.436 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 22' ' ' THR . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.491 HD22 HG21 ' A' ' 61' ' ' ILE . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.491 HG21 HD22 ' A' ' 56' ' ' LEU . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.453 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.553 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.428 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.5 mpp? . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -169.4 156.77 6.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.733 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt -108.54 172.32 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.876 ' O ' HD23 ' A' ' 15' ' ' LEU . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.876 HD23 ' O ' ' A' ' 14' ' ' THR . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.479 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.646 ' C ' HD12 ' A' ' 44' ' ' ILE . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.646 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.549 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.47 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.565 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 61' ' ' ILE . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.554 HG21 HD22 ' A' ' 56' ' ' LEU . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.488 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt -109.55 141.33 42.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -90.83 120.51 31.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.617 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.3 tp -167.85 86.93 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.548 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -98.33 152.38 19.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.667 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.8 -48.96 0.08 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.809 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.913 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.536 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.7 pt20 -168.53 152.12 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.774 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.46 HD12 ' CD1' ' A' ' 67' ' ' LEU . 9.0 pt -108.5 172.57 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.568 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.494 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 44' ' ' ILE . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.623 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 22' ' ' THR . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 61' ' ' ILE . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 56' ' ' LEU . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.536 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.46 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt -99.66 123.14 43.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -90.69 125.13 35.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.693 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.466 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.5 tt -170.43 96.07 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.47 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.65 154.94 20.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.59 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.37 21.47 3.1 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.917 -179.963 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.557 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -153.16 138.48 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.475 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt -107.9 171.44 2.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.896 ' O ' HD23 ' A' ' 15' ' ' LEU . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.703 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.495 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.621 ' HE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 44' ' ' ILE . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.63 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.509 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.478 HD22 HG21 ' A' ' 61' ' ' ILE . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HD22 ' A' ' 56' ' ' LEU . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.557 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.643 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.624 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt -99.08 126.12 44.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -90.77 129.33 36.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.534 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.99 -178.93 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.623 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -100.46 138.01 38.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.617 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.76 -117.18 4.39 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.757 0 CA-C-O 118.015 -1.436 . . . . 0.0 110.958 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 24.8 mt-30 -138.59 133.96 33.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.403 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt -108.06 171.4 2.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.549 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 38' ' ' PRO . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.517 HH11 ' NH2' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 44' ' ' ILE . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 22' ' ' THR . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt -102.06 122.76 44.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.517 ' NH2' HH11 ' A' ' 42' ' ' ARG . 3.4 tmm_? -93.93 127.33 39.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.564 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -169.61 70.51 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.586 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.63 129.27 32.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -97.86 49.85 1.4 Allowed Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.832 0 CA-C-O 118.025 -1.43 . . . . 0.0 110.94 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.588 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 63' ' ' LYS . 9.5 pt20 -167.45 149.86 5.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.89 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -108.54 167.04 4.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.426 HG22 ' HB2' ' A' ' 67' ' ' LEU . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HZ2' HG21 ' A' ' 66' ' ' THR . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.575 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.575 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.46 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.458 HE22 ' N ' ' A' ' 31' ' ' GLN . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' N ' HD22 ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.515 ' N ' ' OD1' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 22' ' ' THR . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.566 HD22 HG21 ' A' ' 61' ' ' ILE . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.566 HG21 HD22 ' A' ' 56' ' ' LEU . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.496 HG21 ' HZ2' ' A' ' 6' ' ' LYS . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.426 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -99.98 116.22 31.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -91.38 139.75 30.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -167.51 98.76 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.536 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.35 154.94 42.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.503 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.68 101.28 0.62 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.695 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.972 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.526 ' O ' ' O ' ' A' ' 63' ' ' LYS . 12.8 pt20 -161.59 150.15 15.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.6 166.59 4.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 67' ' ' LEU . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.891 ' O ' HD23 ' A' ' 15' ' ' LEU . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.548 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.888 HD13 HD21 ' A' ' 71' ' ' LEU . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.548 HE22 ' N ' ' A' ' 31' ' ' GLN . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.41 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG21 HD22 ' A' ' 56' ' ' LEU . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.526 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.419 ' O ' HD12 ' A' ' 67' ' ' LEU . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 4' ' ' PHE . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.888 HD21 HD13 ' A' ' 36' ' ' ILE . 47.2 mt -99.58 141.47 32.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -98.3 117.28 32.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.558 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.77 105.27 0.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.504 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 -142.48 140.34 31.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 156.64 38.68 0.02 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.808 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mpp? . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.8 pt20 -147.29 132.41 18.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.66 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -108.37 163.43 5.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.527 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.427 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 22' ' ' THR . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 61' ' ' ILE . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.49 HG21 HD22 ' A' ' 56' ' ' LEU . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.638 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.626 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt -99.55 124.7 44.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -91.05 127.73 36.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.375 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mt -160.59 102.16 1.35 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -146.13 125.5 13.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -44.68 -86.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.075 -1.403 . . . . 0.0 111.019 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 3.2 pt20 -160.84 150.43 17.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.602 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt -108.59 172.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 70' ' ' VAL . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.871 ' O ' HD23 ' A' ' 15' ' ' LEU . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.3 m120 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.518 ' C ' HE22 ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.518 HE22 ' C ' ' A' ' 27' ' ' LYS . 15.1 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 48' ' ' LYS . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 22' ' ' THR . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.447 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt -99.57 126.92 45.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.433 ' NH2' ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -93.38 115.35 27.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.522 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.433 ' C ' ' NH2' ' A' ' 72' ' ' ARG . 58.1 mt -118.87 129.95 55.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.519 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -101.63 142.63 32.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.519 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.43 23.03 71.71 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.786 0 CA-C-O 117.965 -1.464 . . . . 0.0 110.968 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.511 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.4 pt20 -171.22 150.9 3.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.455 HD12 ' CD1' ' A' ' 67' ' ' LEU . 6.9 pt -108.82 172.56 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.899 ' O ' HD23 ' A' ' 15' ' ' LEU . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.899 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.593 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.802 HG22 ' NZ ' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.802 ' NZ ' HG22 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.438 ' CG2' HD21 ' A' ' 71' ' ' LEU . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.546 ' O ' HD23 ' A' ' 71' ' ' LEU . 6.2 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.478 ' HE ' HD11 ' A' ' 44' ' ' ILE . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 44' ' ' ILE . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 HG21 ' A' ' 61' ' ' ILE . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.462 HG21 HD22 ' A' ' 56' ' ' LEU . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.511 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.455 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 40' ' ' GLN . 2.9 mt -99.76 137.22 38.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttt85 -90.7 125.05 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.532 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.27 108.62 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.593 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -102.9 125.92 49.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.547 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 152.34 116.29 0.67 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.704 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.912 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.55 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -163.66 150.53 12.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.455 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.462 HD12 ' CD1' ' A' ' 67' ' ' LEU . 13.6 pt -108.16 172.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.532 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.901 ' O ' HD23 ' A' ' 15' ' ' LEU . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 14' ' ' THR . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.471 HG21 HD21 ' A' ' 71' ' ' LEU . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.601 ' O ' HD23 ' A' ' 71' ' ' LEU . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.63 ' CZ ' HH22 ' A' ' 72' ' ' ARG . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 44' ' ' ILE . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.638 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 22' ' ' THR . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.431 HD22 HG21 ' A' ' 61' ' ' ILE . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.431 HG21 HD22 ' A' ' 56' ' ' LEU . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.55 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 40' ' ' GLN . 12.2 mt -100.65 129.05 46.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.63 HH22 ' CZ ' ' A' ' 42' ' ' ARG . 14.3 ttt85 -101.77 157.23 16.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.484 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 72' ' ' ARG . 3.9 mp 56.19 113.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.711 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -136.46 154.01 50.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.528 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.57 -60.05 2.04 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.77 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.92 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtp . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.7 mm-40 -48.07 158.01 0.26 Allowed 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.61 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt -150.68 172.83 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.533 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.87 ' O ' HD23 ' A' ' 15' ' ' LEU . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.87 HD23 ' O ' ' A' ' 14' ' ' THR . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.559 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.4 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 44' ' ' ILE . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.62 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt -109.42 123.11 48.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -90.47 126.7 35.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.736 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.38 -177.32 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -126.1 143.69 51.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.504 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.17 158.17 27.59 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.053 -1.415 . . . . 0.0 110.92 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 63' ' ' LYS . 39.9 mt-30 -45.79 159.95 0.06 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.571 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt -150.59 173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.586 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HZ2' HG22 ' A' ' 23' ' ' ILE . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 22' ' ' THR . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLN . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt -99.35 133.99 42.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.83 131.27 36.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.19 122.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -140.21 132.56 28.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.37 -23.53 0.24 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.78 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.934 -179.986 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mtt . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.8 pt20 -69.41 165.32 21.08 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.651 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -147.07 173.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG11 HD11 ' A' ' 30' ' ' ILE . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.477 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.477 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.498 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.456 HG22 ' CE ' ' A' ' 27' ' ' LYS . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' CE ' HG22 ' A' ' 23' ' ' ILE . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.447 HD13 HD12 ' A' ' 69' ' ' LEU . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.507 ' O ' HD23 ' A' ' 71' ' ' LEU . 11.7 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' HD22 ' A' ' 43' ' ' LEU . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.648 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.622 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt -103.06 114.27 28.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -90.63 115.32 27.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.615 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tt -168.38 54.52 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.369 0.604 . . . . 0.0 110.373 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -140.58 152.19 45.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.614 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -98.02 -57.65 1.01 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.737 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.923 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.561 ' O ' ' O ' ' A' ' 63' ' ' LYS . 28.7 tt0 64.87 82.82 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.23 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.555 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.3 pt -107.91 172.49 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' A' ' 67' ' ' LEU . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.898 ' O ' HD23 ' A' ' 15' ' ' LEU . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.898 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.426 ' HA ' ' H ' ' A' ' 2' ' ' GLN . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.694 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.416 ' CG2' HD21 ' A' ' 71' ' ' LEU . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.465 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.591 ' C ' HD12 ' A' ' 44' ' ' ILE . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.3 tt0 -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 22' ' ' THR . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 HG21 ' A' ' 61' ' ' ILE . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.461 HG21 HD22 ' A' ' 56' ' ' LEU . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 2' ' ' GLN . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.431 ' HB2' HG22 ' A' ' 5' ' ' VAL . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.635 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.633 ' N ' HD23 ' A' ' 69' ' ' LEU . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.416 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.8 mt -104.39 140.76 37.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -90.57 144.01 26.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.41 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.15 138.73 7.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -131.01 128.03 39.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.534 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.8 -33.13 86.43 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.715 0 CA-C-O 118.045 -1.419 . . . . 0.0 110.971 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.556 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.49 135.63 38.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.568 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt -107.79 172.51 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.444 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.92 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.887 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.887 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.536 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.447 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.536 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.704 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.495 ' NE2' ' O ' ' A' ' 27' ' ' LYS . 11.9 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.554 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.45 HD22 HG21 ' A' ' 61' ' ' ILE . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.45 HG21 HD22 ' A' ' 56' ' ' LEU . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt -99.34 143.75 29.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.98 154.33 47.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.882 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.5 mt 56.73 97.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.478 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -106.81 137.49 44.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.548 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.6 -61.34 6.33 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.733 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.879 -179.894 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.471 ' O ' ' CB ' ' A' ' 2' ' ' GLN . 10.2 ttm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.575 ' O ' ' O ' ' A' ' 63' ' ' LYS . 20.6 tt0 81.47 80.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.545 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.9 pt -108.42 171.63 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.597 ' CG2' HD11 ' A' ' 13' ' ' ILE . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.597 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.878 ' O ' HD23 ' A' ' 15' ' ' LEU . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.69 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.593 ' CG2' HD21 ' A' ' 71' ' ' LEU . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.473 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m120 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.575 ' O ' ' O ' ' A' ' 2' ' ' GLN . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.639 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.637 ' N ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.593 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.4 mt -106.55 115.7 30.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.0 tmm_? -93.25 124.97 37.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.354 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.455 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.4 tt -148.22 99.38 3.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.582 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.7 mtp85 -105.25 129.14 53.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.482 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 55.6 -142.87 36.49 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.724 0 CA-C-O 117.932 -1.482 . . . . 0.0 111.013 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.551 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -129.57 136.09 49.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.353 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -107.88 172.14 2.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.698 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.798 ' O ' HD23 ' A' ' 71' ' ' LEU . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.796 ' HE ' ' HE ' ' A' ' 72' ' ' ARG . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 61' ' ' ILE . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.433 HG21 HD22 ' A' ' 56' ' ' LEU . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.551 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.653 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.64 ' N ' HD23 ' A' ' 69' ' ' LEU . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 40' ' ' GLN . 4.7 mt -99.94 114.52 27.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.796 ' HE ' ' HE ' ' A' ' 42' ' ' ARG . 10.0 ttm180 -103.5 142.03 34.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.388 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.94 107.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.559 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -101.95 137.05 40.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.574 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 162.0 -62.41 0.28 Allowed Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.924 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.485 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpp? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.532 ' O ' ' O ' ' A' ' 63' ' ' LYS . 8.9 pt20 -171.1 148.7 2.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.762 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.75 172.44 2.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.615 ' NZ ' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.89 ' O ' HD23 ' A' ' 15' ' ' LEU . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.89 HD23 ' O ' ' A' ' 14' ' ' THR . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.584 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.514 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.606 HH11 ' NE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 22' ' ' THR . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.42 HD22 HG21 ' A' ' 61' ' ' ILE . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.42 HG21 HD22 ' A' ' 56' ' ' LEU . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.615 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 70' ' ' VAL . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.647 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt -100.95 143.81 30.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.606 ' NE ' HH11 ' A' ' 42' ' ' ARG . 0.9 OUTLIER -93.91 120.27 33.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.506 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.38 101.46 3.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.46 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.22 141.87 51.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.631 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.7 -20.05 25.42 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.785 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.982 -179.973 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtp . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.5 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.6 mt-30 -96.38 164.17 12.75 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt -150.5 173.72 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 67' ' ' LEU . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' CB ' ' NZ ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.897 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.897 HD23 ' O ' ' A' ' 14' ' ' THR . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.44 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.426 HG21 HD21 ' A' ' 71' ' ' LEU . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.617 ' O ' HD23 ' A' ' 71' ' ' LEU . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.516 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.449 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.5 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.479 ' HB2' HG22 ' A' ' 5' ' ' VAL . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt -100.45 127.04 46.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' C ' HD12 ' A' ' 73' ' ' LEU . 5.2 ttt180 -91.58 114.63 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.781 ' N ' HD12 ' A' ' 73' ' ' LEU . 5.1 mp -95.87 165.37 12.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.481 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -102.81 154.12 19.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.619 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.82 -125.99 1.0 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.649 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.904 -179.959 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.586 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.538 ' O ' ' O ' ' A' ' 63' ' ' LYS . 16.6 pt20 -164.69 151.27 10.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.564 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt -108.21 172.76 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.453 HG22 ' HB2' ' A' ' 67' ' ' LEU . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.553 HD11 HG13 ' A' ' 70' ' ' VAL . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.873 ' O ' HD23 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.873 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.479 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.41 ' C ' HE22 ' A' ' 41' ' ' GLN . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.473 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.41 HE22 ' C ' ' A' ' 27' ' ' LYS . 26.8 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 43' ' ' LEU . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.436 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 22' ' ' THR . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.491 HD22 HG21 ' A' ' 61' ' ' ILE . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.491 HG21 HD22 ' A' ' 56' ' ' LEU . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.538 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.453 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.553 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt -99.86 121.24 41.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -94.01 125.74 38.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.599 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.406 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.2 tt -162.36 101.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.14 134.06 29.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.567 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -86.22 -44.6 5.88 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.73 0 CA-C-O 117.973 -1.459 . . . . 0.0 110.958 179.97 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt . . . . . 0 C--O 1.23 0.065 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.876 ' O ' HD23 ' A' ' 15' ' ' LEU . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.876 HD23 ' O ' ' A' ' 14' ' ' THR . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.479 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.491 ' CZ ' HE22 ' A' ' 49' ' ' GLN . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.646 ' C ' HD12 ' A' ' 44' ' ' ILE . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.646 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.549 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.47 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.491 HE22 ' CZ ' ' A' ' 42' ' ' ARG . 20.5 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.565 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 61' ' ' ILE . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.554 HG21 HD22 ' A' ' 56' ' ' LEU . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.488 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.46 HD12 ' CD1' ' A' ' 67' ' ' LEU . 9.0 pt . . . . . 0 C--O 1.231 0.085 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.568 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.494 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 44' ' ' ILE . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.623 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 22' ' ' THR . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 61' ' ' ILE . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 56' ' ' LEU . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.46 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.896 ' O ' HD23 ' A' ' 15' ' ' LEU . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.703 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.495 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.621 ' HE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 44' ' ' ILE . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.63 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.509 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.478 HD22 HG21 ' A' ' 61' ' ' ILE . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HD22 ' A' ' 56' ' ' LEU . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.643 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.624 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.231 0.124 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.549 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 38' ' ' PRO . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 44' ' ' ILE . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 22' ' ' THR . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.231 0.088 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.426 HG22 ' HB2' ' A' ' 67' ' ' LEU . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HZ2' HG21 ' A' ' 66' ' ' THR . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.575 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.575 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.46 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.458 HE22 ' N ' ' A' ' 31' ' ' GLN . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.514 ' N ' HD22 ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.515 ' N ' ' OD1' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 22' ' ' THR . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.566 HD22 HG21 ' A' ' 61' ' ' ILE . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.566 HG21 HD22 ' A' ' 56' ' ' LEU . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.496 HG21 ' HZ2' ' A' ' 6' ' ' LYS . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.426 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt . . . . . 0 N--CA 1.461 0.116 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 67' ' ' LEU . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.891 ' O ' HD23 ' A' ' 15' ' ' LEU . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.548 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.888 HD13 HD21 ' A' ' 71' ' ' LEU . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.548 HE22 ' N ' ' A' ' 31' ' ' GLN . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.41 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG21 HD22 ' A' ' 56' ' ' LEU . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.419 ' O ' HD12 ' A' ' 67' ' ' LEU . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 4' ' ' PHE . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.888 HD21 HD13 ' A' ' 36' ' ' ILE . 47.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.461 0.118 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.527 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.427 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 22' ' ' THR . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 61' ' ' ILE . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.49 HG21 HD22 ' A' ' 56' ' ' LEU . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.638 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.626 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 70' ' ' VAL . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.871 ' O ' HD23 ' A' ' 15' ' ' LEU . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.1 m-80 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.4 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 48' ' ' LYS . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 22' ' ' THR . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.447 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.455 HD12 ' CD1' ' A' ' 67' ' ' LEU . 6.9 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.899 ' O ' HD23 ' A' ' 15' ' ' LEU . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.899 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.593 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.802 HG22 ' NZ ' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.802 ' NZ ' HG22 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.438 ' CG2' HD21 ' A' ' 71' ' ' LEU . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.546 ' O ' HD23 ' A' ' 71' ' ' LEU . 2.9 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.478 ' HE ' HD11 ' A' ' 44' ' ' ILE . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 44' ' ' ILE . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' NE2' ' NE ' ' A' ' 42' ' ' ARG . 54.5 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 HG21 ' A' ' 61' ' ' ILE . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.462 HG21 HD22 ' A' ' 56' ' ' LEU . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.455 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 40' ' ' GLN . 2.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.462 HD12 ' CD1' ' A' ' 67' ' ' LEU . 13.6 pt . . . . . 0 C--O 1.231 0.1 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.532 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.901 ' O ' HD23 ' A' ' 15' ' ' LEU . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 14' ' ' THR . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.471 HG21 HD21 ' A' ' 71' ' ' LEU . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.601 ' O ' HD23 ' A' ' 71' ' ' LEU . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 44' ' ' ILE . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.638 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 22' ' ' THR . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.431 HD22 HG21 ' A' ' 61' ' ' ILE . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.417 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.5 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.431 HG21 HD22 ' A' ' 56' ' ' LEU . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 40' ' ' GLN . 12.2 mt . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt . . . . . 0 C--O 1.232 0.171 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.533 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.87 ' O ' HD23 ' A' ' 15' ' ' LEU . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.87 HD23 ' O ' ' A' ' 14' ' ' THR . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.559 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.4 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 44' ' ' ILE . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.62 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt . . . . . 0 N--CA 1.463 0.186 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.586 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HZ2' HG22 ' A' ' 23' ' ' ILE . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 22' ' ' THR . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 N--CA 1.464 0.27 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG11 HD11 ' A' ' 30' ' ' ILE . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.477 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.477 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.498 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.456 HG22 ' CE ' ' A' ' 27' ' ' LYS . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' CE ' HG22 ' A' ' 23' ' ' ILE . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.447 HD13 HD12 ' A' ' 69' ' ' LEU . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.507 ' O ' HD23 ' A' ' 71' ' ' LEU . 11.7 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' HD22 ' A' ' 43' ' ' LEU . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.41 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.9 OUTLIER 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.648 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.622 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.555 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.3 pt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' A' ' 67' ' ' LEU . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.898 ' O ' HD23 ' A' ' 15' ' ' LEU . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.898 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.694 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.416 ' CG2' HD21 ' A' ' 71' ' ' LEU . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.672 ' NH1' HE21 ' A' ' 49' ' ' GLN . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.591 ' C ' HD12 ' A' ' 44' ' ' ILE . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.672 HE21 ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 22' ' ' THR . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 HG21 ' A' ' 61' ' ' ILE . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.461 HG21 HD22 ' A' ' 56' ' ' LEU . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.555 ' C ' HG22 ' A' ' 3' ' ' ILE . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.431 ' HB2' HG22 ' A' ' 5' ' ' VAL . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.635 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.633 ' N ' HD23 ' A' ' 69' ' ' LEU . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.416 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.444 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.92 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.887 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.887 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.536 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.447 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.536 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.704 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.672 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.672 HE22 ' N ' ' A' ' 31' ' ' GLN . 37.1 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.554 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.45 HD22 HG21 ' A' ' 61' ' ' ILE . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.45 HG21 HD22 ' A' ' 56' ' ' LEU . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.545 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.9 pt . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.597 ' CG2' HD11 ' A' ' 13' ' ' ILE . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.597 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.878 ' O ' HD23 ' A' ' 15' ' ' LEU . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.69 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.593 ' CG2' HD21 ' A' ' 71' ' ' LEU . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.473 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.511 ' N ' HD22 ' A' ' 60' ' ' ASN . 1.0 OUTLIER 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' C ' HG22 ' A' ' 3' ' ' ILE . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.639 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.637 ' N ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.593 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.4 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt . . . . . 0 C--O 1.232 0.141 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.698 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.798 ' O ' HD23 ' A' ' 71' ' ' LEU . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.423 ' NH2' HE22 ' A' ' 49' ' ' GLN . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.423 HE22 ' NH2' ' A' ' 42' ' ' ARG . 43.5 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 61' ' ' ILE . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.576 ' N ' ' ND2' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.433 HG21 HD22 ' A' ' 56' ' ' LEU . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.653 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.64 ' N ' HD23 ' A' ' 69' ' ' LEU . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 40' ' ' GLN . 4.7 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.615 ' NZ ' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.89 ' O ' HD23 ' A' ' 15' ' ' LEU . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.89 HD23 ' O ' ' A' ' 14' ' ' THR . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.584 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.514 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 22' ' ' THR . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.42 HD22 HG21 ' A' ' 61' ' ' ILE . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.42 HG21 HD22 ' A' ' 56' ' ' LEU . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.615 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 70' ' ' VAL . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.647 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt . . . . . 0 N--CA 1.464 0.236 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 67' ' ' LEU . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' CB ' ' NZ ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.897 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.897 HD23 ' O ' ' A' ' 14' ' ' THR . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.44 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.426 HG21 HD21 ' A' ' 71' ' ' LEU . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.617 ' O ' HD23 ' A' ' 71' ' ' LEU . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.516 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.449 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.533 ' N ' HD22 ' A' ' 60' ' ' ASN . 1.3 m120 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.479 ' HB2' HG22 ' A' ' 5' ' ' VAL . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt . . . . . 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.453 HG22 ' HB2' ' A' ' 67' ' ' LEU . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.553 HD11 HG13 ' A' ' 70' ' ' VAL . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.873 ' O ' HD23 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.873 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.479 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.473 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 43' ' ' LEU . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.436 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 22' ' ' THR . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.491 HD22 HG21 ' A' ' 61' ' ' ILE . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.491 HG21 HD22 ' A' ' 56' ' ' LEU . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.453 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.553 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.428 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.5 mpp? . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -169.4 156.77 6.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.733 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt -108.54 172.32 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -116.05 137.18 52.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.521 -178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -124.76 114.12 39.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -101.21 136.41 41.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 111.367 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 p -107.15 178.67 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mt -70.77 -8.88 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.523 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.2 p -90.57 -11.32 40.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.466 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.57 -5.61 77.21 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -74.98 120.9 21.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.1 m -98.45 113.47 25.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.41 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.9 125.6 45.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.876 ' O ' HD23 ' A' ' 15' ' ' LEU . 62.3 m -102.93 129.29 49.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.876 HD23 ' O ' ' A' ' 14' ' ' THR . 2.7 mt -143.33 163.63 32.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.01 0.433 . . . . 0.0 111.285 -179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -95.67 132.45 40.83 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.5 m -143.87 152.82 15.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.199 -0.6 . . . . 0.0 112.078 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 2.0 mm-40 -116.03 -179.39 0.62 Allowed Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.382 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 5.1 Cg_exo -74.06 8.75 1.95 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.738 1.625 . . . . 0.0 112.447 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 p -119.18 7.42 11.32 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.344 1.069 . . . . 0.0 109.376 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.53 48.14 1.01 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.186 -1.825 . . . . 0.0 109.522 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.24 146.66 53.96 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.295 -173.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.16 -30.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.215 -1.811 . . . . 0.0 111.715 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -69.69 -49.28 54.98 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 7.2 t30 -70.81 -43.59 68.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.513 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.78 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.735 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -60.4 -33.84 73.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.11 75.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -63.51 -43.37 97.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.769 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.3 mt -69.39 -37.35 75.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.373 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.479 ' O ' ' N ' ' A' ' 35' ' ' GLY . 3.2 tt0 -57.64 -46.67 83.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -65.3 -16.79 63.94 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.993 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.95 -42.68 7.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.739 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -103.01 -23.87 13.67 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.83 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.35 26.88 50.48 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 77.8 mt -101.11 106.25 43.75 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 71.9 Cg_exo -46.34 137.35 14.52 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.767 1.645 . . . . 0.0 111.793 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -42.36 -16.18 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.127 1.885 . . . . 0.0 112.514 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.32 -29.17 63.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.291 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -104.63 10.24 34.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.964 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 61.1 mt-30 -103.3 125.3 49.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.741 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.491 ' CZ ' HE22 ' A' ' 49' ' ' GLN . 6.5 mtt180 -132.03 116.73 17.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.204 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.646 ' C ' HD12 ' A' ' 44' ' ' ILE . 28.5 mt -99.0 120.68 39.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.959 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.646 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.74 135.61 56.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.979 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.549 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.6 t80 -142.08 118.56 10.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.866 0.365 . . . . 0.0 110.583 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.47 39.0 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.39 -6.15 1.87 Allowed Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.47 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -98.11 141.44 31.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.845 0.355 . . . . 0.0 110.558 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.491 HE22 ' CZ ' ' A' ' 42' ' ' ARG . 20.5 tt0 -85.71 142.71 28.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.331 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.95 154.11 17.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.832 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -120.96 155.12 34.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.55 123.46 26.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.554 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.94 -30.59 2.73 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.565 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -91.07 147.39 23.11 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -101.8 168.85 9.18 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.004 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 61' ' ' ILE . 71.9 mt -56.78 -35.33 68.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.32 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -27.81 63.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.995 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -75.66 -37.18 59.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -85.27 2.24 44.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 109.975 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 68.49 17.98 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.888 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.554 HG21 HD22 ' A' ' 56' ' ' LEU . 30.5 mt -65.12 141.33 18.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.138 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -91.01 -177.1 4.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.931 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.26 -3.16 55.87 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.114 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -126.59 -7.22 6.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.438 0.461 . . . . 0.0 110.534 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.4 m -47.88 162.93 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.037 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.1 m -111.71 121.54 45.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.627 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 mt -104.03 141.81 35.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.838 0.351 . . . . 0.0 110.961 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.488 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -96.56 119.03 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.872 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.86 128.86 44.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.738 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -128.33 145.24 35.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.304 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.6 mt -109.55 141.33 42.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.738 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -90.83 120.51 31.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.617 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.3 tp -167.85 86.93 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.548 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -98.33 152.38 19.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.667 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.8 -48.96 0.08 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.809 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.913 -179.988 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.536 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.7 pt20 -168.53 152.12 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.774 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.46 HD12 ' CD1' ' A' ' 67' ' ' LEU . 9.0 pt -108.5 172.57 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -118.43 136.33 53.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.5 t -124.51 114.43 40.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.2 mttm -102.24 133.53 46.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.355 . . . . 0.0 111.227 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.19 178.78 4.45 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.372 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.05 -6.65 35.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.509 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 19.2 p -91.21 -1.28 57.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.59 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.94 2.83 83.31 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 tttp -85.02 125.46 32.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.772 0.32 . . . . 0.0 110.716 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.7 m -100.85 113.16 25.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.504 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.49 125.22 46.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.606 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 60.9 m -103.47 129.37 50.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.818 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.88 160.69 39.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.922 0.391 . . . . 0.0 111.164 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -95.38 125.33 39.93 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.61 148.28 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.568 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 25.1 mt-10 -117.69 147.77 41.67 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.407 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 21' ' ' ASP . 88.6 Cg_exo -29.66 -40.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 123.129 2.553 . . . . 0.0 114.626 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.1 p -78.81 14.05 1.48 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.82 0.819 . . . . 0.0 111.142 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.56 48.05 1.13 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.204 -1.362 . . . . 0.0 109.85 178.23 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -64.24 145.63 55.67 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.056 -173.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.2 mm -26.16 -40.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.837 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 22' ' ' THR . 4.2 tm-20 -64.72 -47.69 77.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.875 0.369 . . . . 0.0 110.16 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.608 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.3 m120 -70.98 -43.73 67.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.11 -42.95 95.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.896 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 11.2 mttm -60.54 -32.39 71.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.497 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.97 -36.98 80.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.612 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -67.24 -43.05 82.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.636 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.9 mt -67.33 -37.33 78.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.604 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 5.7 tt0 -57.22 -47.09 82.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.55 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.55 -16.06 61.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.831 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -96.31 -42.77 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.921 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -105.99 -24.14 12.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.36 28.61 35.8 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.486 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 64.7 mt -102.67 104.84 41.13 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.441 ' O ' ' N ' ' A' ' 39' ' ' ASP . 77.2 Cg_exo -46.01 137.61 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.771 1.647 . . . . 0.0 111.829 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -42.32 -21.86 0.2 Allowed 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.002 1.802 . . . . 0.0 112.379 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -72.66 -31.35 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -100.02 9.99 42.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.653 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.494 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 46.9 mt-30 -101.74 129.16 47.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.634 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.411 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -131.97 109.44 10.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.364 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 44' ' ' ILE . 11.6 mt -100.41 119.93 39.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.821 0.343 . . . . 0.0 110.538 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.623 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.2 136.3 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.398 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -142.82 135.43 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.603 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.12 21.34 9.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.635 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.76 -3.45 83.25 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -103.62 142.63 33.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.786 0.327 . . . . 0.0 110.508 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -85.07 136.39 33.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.486 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -89.36 126.49 35.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.653 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -91.62 154.03 19.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.445 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.6 115.71 15.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.584 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.3 -35.47 1.82 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.82 151.39 27.4 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.765 HG22 HG22 ' A' ' 22' ' ' THR . 43.0 p -102.84 164.21 11.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.035 0.445 . . . . 0.0 111.891 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 61' ' ' ILE . 63.3 mt -56.42 -34.5 66.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.523 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -30.69 67.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.759 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -71.21 -35.12 71.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.811 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.41 2.72 49.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.957 0.408 . . . . 0.0 110.074 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 m120 62.33 24.68 14.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 56' ' ' LEU . 10.4 mt -68.07 144.58 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.296 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -90.89 165.83 13.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.993 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.536 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -81.45 -3.21 52.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.784 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -126.91 -7.67 6.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.245 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.48 164.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.596 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -115.32 119.82 37.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.07 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.46 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.2 mp -104.06 154.82 19.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.833 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -104.98 119.62 39.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.059 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.93 110.26 22.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.705 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.411 ' O ' ' CB ' ' A' ' 42' ' ' ARG . 1.7 t -115.68 145.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.328 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.5 mt -99.66 123.14 43.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.532 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -90.69 125.13 35.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.693 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.466 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.5 tt -170.43 96.07 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.47 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.65 154.94 20.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.59 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.37 21.47 3.1 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.917 -179.963 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpp? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.557 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -153.16 138.48 17.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.475 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 pt -107.9 171.44 2.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -118.01 137.23 53.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.91 0.386 . . . . 0.0 111.365 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -125.1 114.22 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.742 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -103.04 137.26 41.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.935 0.398 . . . . 0.0 111.22 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 69' ' ' LEU . 44.0 p -107.22 178.85 4.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.299 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 mt -68.43 -7.85 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.441 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.9 p -92.35 -5.7 51.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.496 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.69 -4.43 85.79 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -73.8 125.86 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.7 0.286 . . . . 0.0 110.577 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.3 m -103.22 113.2 26.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.551 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.26 47.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.543 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.896 ' O ' HD23 ' A' ' 15' ' ' LEU . 82.1 m -101.54 129.1 47.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.762 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.43 160.07 40.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.86 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -95.34 126.52 40.71 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -138.21 164.1 27.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.228 0.537 . . . . 0.0 112.282 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mt-10 -127.22 179.17 1.29 Allowed Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.846 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -71.69 6.67 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.937 1.758 . . . . 0.0 112.758 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.1 p -117.74 7.92 12.62 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.259 1.028 . . . . 0.0 109.393 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.78 48.5 1.08 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.229 -1.805 . . . . 0.0 109.593 178.724 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.06 146.52 54.01 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 122.042 0.925 . . . . 0.0 110.994 -173.059 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.703 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.79 -30.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.233 -1.803 . . . . 0.0 111.64 -177.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.6 OUTLIER -69.94 -48.76 57.18 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.587 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -71.07 -43.92 66.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.665 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.36 -41.07 83.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.1 mttm -60.37 -32.51 71.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.378 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.73 71.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -60.72 -43.13 98.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.782 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mt -67.52 -38.49 80.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 35' ' ' GLY . 25.2 tt0 -58.1 -46.13 86.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -66.08 -16.9 64.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.987 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -96.74 -42.64 7.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.69 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -101.87 -23.97 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.825 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.57 23.78 55.35 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.5 mt -97.75 133.06 23.86 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.52 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.28 136.1 21.51 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 121.761 1.64 . . . . 0.0 111.923 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.68 -16.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.333 0 C-N-CA 122.083 1.855 . . . . 0.0 112.656 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.7 t70 -73.61 -26.84 60.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.431 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -110.14 9.63 23.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.876 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.495 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 33.2 mt-30 -104.14 125.81 50.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.771 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.621 ' HE ' ' NE2' ' A' ' 49' ' ' GLN . 4.4 ttt180 -132.19 115.69 16.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.103 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 44' ' ' ILE . 78.2 mt -95.3 121.0 36.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.717 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.63 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.19 139.4 41.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.077 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.509 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 79.4 t80 -151.09 125.69 9.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.523 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.5 37.71 1.92 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.54 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 64.27 -3.87 1.57 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' A' ' 46' ' ' ALA . 11.3 ttpp -102.85 143.45 32.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 110.479 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 42' ' ' ARG . 32.5 tt0 -85.11 141.34 30.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.9 mt -94.39 153.96 17.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -126.91 155.51 42.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.549 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 134.98 44.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.515 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.75 -34.26 3.5 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.17 148.43 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.764 HG22 HG22 ' A' ' 22' ' ' THR . 33.9 p -102.77 169.11 8.81 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.187 0.518 . . . . 0.0 111.917 -179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.478 HD22 HG21 ' A' ' 61' ' ' ILE . 75.1 mt -56.55 -34.25 66.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.398 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.66 -31.0 67.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.795 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 2.9 m-20 -75.67 -35.1 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -87.67 16.13 6.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 0.0 109.889 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 60' ' ' ASN . 3.8 p-10 44.55 41.79 5.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.861 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HD22 ' A' ' 56' ' ' LEU . 13.7 mt -85.13 144.16 10.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.026 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -90.54 169.97 10.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.433 . . . . 0.0 110.843 -179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.557 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.4 pttt -82.96 -3.89 57.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.245 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -125.97 -5.97 6.75 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 123.432 0.457 . . . . 0.0 110.583 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.8 m -48.19 166.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.828 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 m -114.91 122.16 45.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.732 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mt -103.99 146.19 29.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.846 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -105.5 123.91 48.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.316 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.643 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.1 tt -98.22 120.56 38.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.564 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.624 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -122.15 146.29 27.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.408 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.2 mt -99.08 126.12 44.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.627 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -90.77 129.33 36.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.534 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.99 -178.93 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.623 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -100.46 138.01 38.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.617 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.76 -117.18 4.39 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.757 0 CA-C-O 118.015 -1.436 . . . . 0.0 110.958 -179.958 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 24.8 mt-30 -138.59 133.96 33.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.403 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.2 pt -108.06 171.4 2.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -119.35 138.87 52.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.98 0.419 . . . . 0.0 111.871 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -124.98 113.87 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.551 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -98.39 137.05 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 111.175 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 p -106.48 178.78 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.574 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 mt -69.97 -11.4 60.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.1 p -92.13 -6.61 50.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.629 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.93 -2.85 84.51 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -73.49 122.36 22.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.836 0.35 . . . . 0.0 110.481 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.8 m -101.27 113.62 26.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.62 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.28 122.81 47.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.643 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 32.1 m -100.96 128.58 46.93 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.4 mt -140.96 159.87 41.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.726 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.15 130.93 41.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -141.55 160.52 21.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.256 0.551 . . . . 0.0 112.018 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.549 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 2.2 mt-10 -122.29 -179.39 0.77 Allowed Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.922 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -74.04 7.81 2.32 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 C-N-CA 121.948 1.765 . . . . 0.0 112.603 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 p -119.26 7.5 11.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.387 1.089 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.7 48.08 1.03 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.216 -1.811 . . . . 0.0 109.33 178.51 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.09 145.95 55.04 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.323 -172.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -26.4 -39.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 113.316 -1.766 . . . . 0.0 111.602 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 22' ' ' THR . 48.2 tt0 -65.24 -49.27 70.28 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.612 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -70.59 -43.85 68.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.55 179.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.53 89.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.958 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 11.0 mttm -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.373 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.81 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.703 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -64.66 -42.97 95.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.642 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.15 -40.21 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.564 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -56.92 -42.46 80.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.452 -179.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -68.38 -16.65 64.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.849 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -96.3 -42.56 8.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.428 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -101.14 -23.92 14.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.593 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 86.77 16.54 61.4 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.7 mt -92.6 132.97 30.28 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 39' ' ' ASP . 61.5 Cg_endo -74.9 137.23 21.67 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 121.823 1.682 . . . . 0.0 111.784 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.431 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 78.2 Cg_exo -42.51 -15.82 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.059 1.84 . . . . 0.0 112.706 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 37' ' ' PRO . 1.1 t0 -74.71 -28.65 60.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.466 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -107.96 9.98 28.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.868 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 38' ' ' PRO . 32.5 mt-30 -101.21 128.25 47.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.783 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.517 HH11 ' NH2' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -132.0 110.55 10.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.527 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 44' ' ' ILE . 49.1 mt -95.13 119.8 34.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.42 139.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.311 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -147.46 140.51 25.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.528 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.33 20.44 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.548 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.1 -3.71 83.37 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -102.56 144.18 31.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.72 0.295 . . . . 0.0 110.543 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -84.89 139.92 31.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.329 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.5 mt -91.6 126.56 36.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.758 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -91.95 152.86 19.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.283 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.16 115.82 17.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.666 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.98 -33.14 1.96 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.455 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -85.3 151.21 24.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 22' ' ' THR . 39.8 p -102.14 167.47 9.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.204 0.526 . . . . 0.0 112.082 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.77 -34.49 67.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.472 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.02 -37.2 72.63 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -65.08 -34.11 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.882 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.37 -0.75 57.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.258 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 66.79 18.75 10.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.707 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 11.9 mt -62.07 143.43 15.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -90.53 172.84 8.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.897 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 3.4 pttt -85.21 -3.41 58.81 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.228 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -126.16 -9.43 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 123.527 0.517 . . . . 0.0 110.187 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.25 153.79 0.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.846 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.1 m -108.36 121.71 45.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.708 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -104.22 160.46 14.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.93 0.395 . . . . 0.0 111.294 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -111.49 123.0 49.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.733 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.77 105.46 17.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.926 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -111.03 143.79 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.229 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 32.8 mt -102.06 122.76 44.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.602 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.517 ' NH2' HH11 ' A' ' 42' ' ' ARG . 3.4 tmm_? -93.93 127.33 39.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.564 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -169.61 70.51 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.586 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.63 129.27 32.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -97.86 49.85 1.4 Allowed Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.832 0 CA-C-O 118.025 -1.43 . . . . 0.0 110.94 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.588 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 63' ' ' LYS . 2.1 pt20 -167.45 149.86 5.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.89 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -108.54 167.04 4.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -111.79 137.28 49.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.426 HG22 ' HB2' ' A' ' 67' ' ' LEU . 73.3 t -124.94 114.37 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.69 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HZ2' HG21 ' A' ' 66' ' ' THR . 21.8 mtmm -98.53 128.69 44.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.917 0.389 . . . . 0.0 111.057 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -106.94 178.73 4.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.201 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.72 -5.95 33.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.513 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 11' ' ' LYS . 5.5 p -93.67 6.03 49.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.546 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.57 -14.89 1.74 Allowed Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 9' ' ' THR . 11.2 tttp -72.68 120.52 18.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 33.0 m -92.98 117.43 30.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.591 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.49 121.01 42.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.69 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 90.2 m -102.58 128.72 49.12 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.83 162.63 34.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.127 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.476 ' CD ' ' N ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -95.97 126.66 41.37 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.52 148.7 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.313 0.578 . . . . 0.0 112.362 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.575 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 5.3 mm-40 -113.42 148.64 40.07 Favored Pre-proline 0 C--O 1.224 -0.277 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.296 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -32.89 -39.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 122.77 2.313 . . . . 0.0 114.215 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 p -78.9 13.9 1.56 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.664 0.745 . . . . 0.0 111.231 -178.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.575 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.37 48.06 1.11 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.618 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.17 145.86 55.24 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.308 -173.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.46 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.7 mm -25.97 -39.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 113.641 -1.618 . . . . 0.0 111.727 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 22' ' ' THR . 57.5 tt0 -64.46 -51.05 65.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.595 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t30 -70.82 -43.92 67.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.36 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.52 -40.71 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.75 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 17.4 mttm -60.3 -32.4 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 0.0 110.437 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.06 -39.75 82.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.738 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.4 -43.24 98.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.74 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -67.75 -37.03 77.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.2 tt0 -56.98 -46.7 82.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.563 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -66.7 -16.66 64.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.197 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -96.34 -42.48 8.13 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.538 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -103.17 -5.26 23.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.426 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.3 14.16 61.44 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.3 mt -90.08 130.0 43.9 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.42 146.96 35.93 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.563 1.508 . . . . 0.0 111.973 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -41.97 -23.9 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.283 1.989 . . . . 0.0 112.586 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -69.74 -30.5 68.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.563 -179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -103.71 9.9 36.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.723 0.297 . . . . 0.0 111.02 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.458 HE22 ' N ' ' A' ' 31' ' ' GLN . 80.9 mt-30 -101.92 127.33 48.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.905 0.383 . . . . 0.0 110.651 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -131.98 112.09 12.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.383 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' N ' HD22 ' A' ' 43' ' ' LEU . 4.0 mm? -95.14 129.39 42.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mt -134.04 129.63 54.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.34 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -134.9 137.01 42.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.43 26.42 16.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.38 23.53 77.05 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.9 mtpp -126.74 142.71 51.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.757 0.313 . . . . 0.0 110.527 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -84.95 131.01 34.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.639 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -91.5 126.74 36.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.45 153.43 21.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.379 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.515 ' N ' ' OD1' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.46 115.88 12.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.544 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.64 -34.27 1.81 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mmt-85 -81.99 150.54 27.59 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 22' ' ' THR . 43.8 p -102.17 164.97 11.4 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.511 -0.476 . . . . 0.0 112.144 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.566 HD22 HG21 ' A' ' 61' ' ' ILE . 58.6 mt -56.19 -35.5 67.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.508 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.3 t -70.93 -33.16 70.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -67.92 -36.6 80.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -85.25 -0.69 55.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.029 0.442 . . . . 0.0 109.944 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 73.46 6.46 5.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.884 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.566 HG21 HD22 ' A' ' 56' ' ' LEU . 27.3 mt -54.14 138.6 13.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -90.79 -177.67 5.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -90.35 -5.26 56.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.204 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.16 -8.19 6.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.275 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -50.78 160.22 0.47 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.672 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.496 HG21 ' HZ2' ' A' ' 6' ' ' LYS . 8.1 m -104.68 133.2 49.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.985 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.426 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.2 mt -115.28 145.04 42.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.796 -179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -99.67 115.88 30.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.174 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.1 tp -98.17 111.59 23.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.544 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -113.15 145.3 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.419 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -99.98 116.22 31.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.588 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -91.38 139.75 30.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.576 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -167.51 98.76 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.536 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.35 154.94 42.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.503 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.68 101.28 0.62 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.695 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.972 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.526 ' O ' ' O ' ' A' ' 63' ' ' LYS . 12.8 pt20 -161.59 150.15 15.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.6 166.59 4.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 67' ' ' LEU . 79.3 m-85 -108.66 137.79 46.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.254 -179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.2 t -124.46 116.7 48.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.721 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -103.56 131.91 50.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.96 0.409 . . . . 0.0 111.23 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.32 178.84 4.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.36 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -7.89 39.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.532 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.1 p -90.74 0.37 57.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.35 1.35 64.48 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -83.04 126.46 32.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.796 0.331 . . . . 0.0 110.622 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 42.9 m -98.51 113.22 25.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.578 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.8 125.19 47.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.851 0.357 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.891 ' O ' HD23 ' A' ' 15' ' ' LEU . 61.3 m -101.82 128.94 47.95 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.8 161.17 38.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.935 0.397 . . . . 0.0 110.936 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -94.73 132.7 39.21 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.71 156.16 16.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.13 -0.628 . . . . 0.0 112.091 -178.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' A' ' 20' ' ' SER . 10.2 mt-10 -126.71 155.78 74.54 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.757 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -45.78 -1.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.405 2.07 . . . . 0.0 114.312 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.571 ' N ' ' O ' ' A' ' 18' ' ' GLU . 12.4 p -112.82 9.83 19.05 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 122.168 0.985 . . . . 0.0 109.659 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -81.22 48.45 1.14 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.429 -1.714 . . . . 0.0 109.787 178.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.47 53.98 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.256 -173.073 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.6 mm -27.09 -36.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 113.42 -1.718 . . . . 0.0 111.579 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 8.7 tt0 -68.85 -49.6 57.03 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.71 -43.85 68.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.52 178.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.93 84.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.4 mttt -60.57 -32.38 71.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.311 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.38 -41.91 88.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.681 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -61.06 -43.17 99.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.568 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 17.6 mt -70.65 -37.35 69.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.527 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.548 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -60.4 -45.62 92.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.653 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -16.33 63.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.815 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -95.25 -42.68 8.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.734 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -105.17 -24.15 12.79 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.1 30.59 28.04 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.888 HD13 HD21 ' A' ' 71' ' ' LEU . 53.3 mt -101.99 105.5 42.41 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -46.57 140.31 12.28 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.734 1.623 . . . . 0.0 111.871 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -41.85 -35.06 2.71 Favored 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.104 1.869 . . . . 0.0 112.632 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -29.11 70.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.221 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -98.71 9.9 42.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.548 HE22 ' N ' ' A' ' 31' ' ' GLN . 77.6 mt-30 -107.64 130.77 54.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.669 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.07 108.03 9.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.248 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 6.4 mt -95.32 121.24 36.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.699 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.48 142.02 31.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.109 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 77.7 t80 -155.51 130.53 9.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.511 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 72.47 22.53 3.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.422 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.05 -5.7 47.39 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.0 145.77 30.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 110.62 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -85.1 137.28 33.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.346 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.5 mt -91.22 126.58 36.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -88.9 152.4 21.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.171 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.6 115.93 12.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.671 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.07 -36.9 1.55 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -82.03 151.88 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.1 p -103.35 168.05 9.42 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.139 0.495 . . . . 0.0 112.143 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.41 HD22 HG21 ' A' ' 61' ' ' ILE . 61.6 mt -56.66 -34.54 67.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.46 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -43.09 72.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.984 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -86.61 -0.66 56.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.988 0.423 . . . . 0.0 110.156 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.96 28.67 14.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.951 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG21 HD22 ' A' ' 56' ' ' LEU . 15.3 mt -72.57 146.96 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.14 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -90.72 171.99 8.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.997 0.427 . . . . 0.0 110.974 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.526 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.42 -4.79 59.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.956 -179.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -126.59 -7.47 6.26 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 0.0 110.253 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.67 163.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.735 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.419 ' O ' HD12 ' A' ' 67' ' ' LEU . 7.1 m -102.17 136.31 42.22 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.963 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 4' ' ' PHE . 6.8 mp -115.02 139.91 49.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.77 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -96.58 115.22 27.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.018 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.9 tp -97.86 108.79 21.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.539 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -110.85 145.53 17.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.333 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.888 HD21 HD13 ' A' ' 36' ' ' ILE . 47.2 mt -99.58 141.47 32.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.538 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -98.3 117.28 32.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.558 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.77 105.27 0.6 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.504 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 -142.48 140.34 31.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 156.64 38.68 0.02 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.808 0 CA-C-O 117.966 -1.464 . . . . 0.0 110.911 -179.98 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mpp? . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.542 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.8 pt20 -147.29 132.41 18.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.66 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -108.37 163.43 5.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -109.19 138.26 45.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.898 0.38 . . . . 0.0 111.57 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.17 116.88 48.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.885 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 31.7 mttm -97.76 132.87 42.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.932 0.396 . . . . 0.0 111.03 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.2 p -107.53 178.87 4.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.353 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.527 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.8 mm? -61.15 -25.23 66.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.743 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.3 p -86.07 6.23 29.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.673 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.47 2.6 35.57 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -72.5 110.87 7.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.279 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.512 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 8.9 m -84.27 113.23 20.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.665 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.89 119.83 45.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.411 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 93.4 m -95.79 128.99 43.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.27 156.87 46.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.64 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.83 127.37 40.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 m -138.39 148.04 25.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.284 0.564 . . . . 0.0 112.432 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.562 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 36.5 mt-10 -113.35 145.52 33.41 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.236 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 21' ' ' ASP . 95.2 Cg_exo -30.6 -38.89 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.864 2.376 . . . . 0.0 114.564 -178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.7 p -79.03 15.34 1.14 Allowed 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.849 0.833 . . . . 0.0 110.935 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.562 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -82.52 48.31 1.28 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.122 -1.399 . . . . 0.0 109.634 178.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -64.1 145.9 55.13 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.067 -173.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.82 -41.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 113.587 -1.642 . . . . 0.0 111.573 -178.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 22' ' ' THR . 42.9 tt0 -62.28 -49.96 73.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 110.09 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.611 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.77 -43.87 67.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.511 179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.04 90.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.813 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.427 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.43 -32.34 71.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -36.9 77.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.66 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -63.13 -43.18 99.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -69.18 -38.54 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.463 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 19.8 tt0 -57.21 -45.67 83.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.509 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.5 -16.57 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -96.77 -42.64 7.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.76 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -103.78 -24.14 13.35 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.688 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.64 29.77 31.55 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.6 mt -103.05 132.9 20.69 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.06 137.33 23.84 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.759 1.64 . . . . 0.0 112.104 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -43.11 -26.18 0.74 Allowed 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.05 1.833 . . . . 0.0 112.496 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.95 -26.08 68.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.668 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -110.29 10.01 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.236 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 6.7 mt-30 -106.35 128.21 53.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.954 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -132.18 111.82 11.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.257 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 10.0 mt -94.93 127.23 40.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.791 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -120.72 137.35 54.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.224 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -147.58 137.26 22.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.29 24.25 14.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.509 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.68 -3.16 61.0 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.826 0.346 . . . . 0.0 110.647 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -85.61 133.02 34.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.439 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.5 mt -89.61 126.55 35.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.645 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.44 153.3 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.37 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -72.36 115.78 12.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.382 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.35 -35.44 1.74 Allowed Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.048 -0.821 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -81.82 151.4 27.39 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.773 HG22 HG22 ' A' ' 22' ' ' THR . 43.4 p -102.56 164.81 11.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.056 0.455 . . . . 0.0 112.092 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 61' ' ' ILE . 69.9 mt -56.26 -35.46 67.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.524 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -29.59 65.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.075 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -72.91 -35.24 67.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.937 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -86.28 -0.82 56.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.045 0.45 . . . . 0.0 110.196 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t30 71.16 10.8 6.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.952 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.49 HG21 HD22 ' A' ' 56' ' ' LEU . 22.6 mt -55.94 142.13 11.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.151 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -90.71 -177.37 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 0.0 111.06 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 2' ' ' GLN . 1.4 pttp -91.75 -6.38 51.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.09 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -126.25 -5.84 6.6 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 123.52 0.513 . . . . 0.0 110.433 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 m -51.84 156.41 1.47 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.559 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -102.44 131.73 48.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.999 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -110.12 150.3 28.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.904 0.383 . . . . 0.0 110.955 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -109.3 122.32 47.08 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.206 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.638 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.0 tt -98.8 120.7 39.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.699 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.626 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.3 t -124.94 145.61 31.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.365 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.1 mt -99.55 124.7 44.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.971 0.415 . . . . 0.0 110.818 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -91.05 127.73 36.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.375 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mt -160.59 102.16 1.35 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.629 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -146.13 125.5 13.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -44.68 -86.91 0.01 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.075 -1.403 . . . . 0.0 111.019 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 63' ' ' LYS . 3.2 pt20 -160.84 150.43 17.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.602 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.8 pt -108.59 172.76 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -117.25 139.27 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.008 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.0 t -124.77 114.3 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -99.4 135.09 41.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.885 0.374 . . . . 0.0 111.072 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 p -105.2 177.76 4.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.4 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 70' ' ' VAL . 2.1 mt -70.84 -6.87 41.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 20.8 p -93.48 -15.25 25.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.644 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -6.53 61.18 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -72.67 129.07 37.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.712 0.291 . . . . 0.0 110.508 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.2 m -103.92 113.17 26.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -93.58 122.98 45.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.871 ' O ' HD23 ' A' ' 15' ' ' LEU . 2.5 m -101.25 129.13 47.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.768 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.871 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.17 161.5 38.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.04 0.448 . . . . 0.0 110.96 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.416 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 5.7 pt-20 -95.73 127.97 42.21 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.16 152.75 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.999 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.489 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.4 mm-40 -115.76 -178.69 0.54 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.727 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.1 Cg_exo -73.18 7.21 2.21 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 121.845 1.697 . . . . 0.0 112.559 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.9 p -118.5 7.34 11.82 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 122.179 0.99 . . . . 0.0 109.494 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.43 48.55 1.04 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.36 -1.746 . . . . 0.0 109.384 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.98 145.51 55.75 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.224 -172.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.7 -41.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.669 -178.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.473 ' N ' ' O ' ' A' ' 22' ' ' THR . 29.1 tt0 -61.03 -49.26 78.11 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.1 m-80 -70.77 -43.62 68.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.334 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.97 77.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.556 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 31.8 mttt -60.6 -41.56 94.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.14 -40.05 93.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.972 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -61.01 -43.05 99.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.973 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.7 mt -69.5 -38.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.595 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.8 OUTLIER -57.38 -43.3 83.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.509 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -16.61 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -95.29 -42.65 8.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.533 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -102.92 -16.05 15.98 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.583 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 82.24 3.38 90.57 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 69.0 mt -81.47 122.3 80.76 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.576 -0.25 . . . . 0.0 110.338 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -43.63 153.47 0.25 Allowed 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.54 1.494 . . . . 0.0 111.625 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.25 -29.34 11.58 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.126 1.884 . . . . 0.0 112.137 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -27.94 61.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -90.95 10.1 27.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.734 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.4 mt-30 -100.18 140.21 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.85 120.27 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.513 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mt -106.47 135.89 47.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.751 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 48' ' ' LYS . 1.4 mt -133.46 144.07 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.398 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 90.1 t80 -144.73 125.55 14.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.391 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 69.78 16.55 7.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.457 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.51 -1.75 84.26 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.7 ttpm? -100.53 140.23 35.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.725 0.298 . . . . 0.0 110.428 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -84.68 134.91 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.623 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.7 mt -93.29 130.57 38.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.8 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.01 152.7 20.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.183 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.6 115.56 13.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.361 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 143.68 -35.7 1.6 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -81.85 152.09 27.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.782 HG22 HG22 ' A' ' 22' ' ' THR . 40.3 p -102.35 167.04 10.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.266 0.555 . . . . 0.0 112.186 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 61' ' ' ILE . 61.7 mt -56.78 -35.74 69.03 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.652 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -36.79 73.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.848 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -64.07 -35.98 82.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.9 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -86.01 0.26 53.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.962 0.411 . . . . 0.0 110.077 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 69.13 16.13 8.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.477 HG21 HD22 ' A' ' 56' ' ' LEU . 22.5 mt -62.07 143.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.222 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -90.75 178.35 6.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.951 -178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.2 OUTLIER -90.09 -4.82 57.12 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.972 -179.527 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.59 -4.91 6.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.458 0.474 . . . . 0.0 110.3 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -53.08 161.46 0.82 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.887 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.6 m -108.2 121.3 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.809 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 5.0 mt -104.16 150.9 23.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 110.831 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -102.94 120.3 40.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.069 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.2 tp -98.2 111.43 23.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.728 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.447 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -118.11 145.47 23.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.115 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 mt -99.57 126.92 45.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 110.706 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.433 ' NH2' ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -93.38 115.35 27.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.522 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.433 ' C ' ' NH2' ' A' ' 72' ' ' ARG . 58.1 mt -118.87 129.95 55.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.519 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -101.63 142.63 32.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.519 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.43 23.03 71.71 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.786 0 CA-C-O 117.965 -1.464 . . . . 0.0 110.968 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.511 ' O ' ' O ' ' A' ' 63' ' ' LYS . 2.3 pt20 -171.22 150.9 3.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.455 HD12 ' CD1' ' A' ' 67' ' ' LEU . 6.9 pt -108.82 172.56 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.92 135.41 54.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 111.45 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -124.5 115.46 44.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.93 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 mttp -103.21 133.8 47.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.921 0.391 . . . . 0.0 111.08 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -106.07 178.77 4.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.359 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -14.19 60.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.52 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 p -86.76 1.84 50.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.515 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 75.46 -2.84 51.41 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -75.4 126.81 31.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 110.534 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.7 m -101.51 114.08 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.8 124.99 48.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.682 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.899 ' O ' HD23 ' A' ' 15' ' ' LEU . 89.2 m -101.65 129.25 47.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.782 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.899 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.53 159.68 41.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.995 0.426 . . . . 0.0 111.075 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -95.58 126.49 40.9 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.8 m -138.79 147.9 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.287 0.565 . . . . 0.0 112.519 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.593 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 6.4 mp0 -110.97 152.61 43.75 Favored Pre-proline 0 C--O 1.223 -0.294 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.507 178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -36.89 -38.36 0.37 Allowed 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 122.415 2.077 . . . . 0.0 113.814 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 p -79.0 12.61 2.12 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.617 0.722 . . . . 0.0 111.537 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.74 48.57 1.08 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.755 177.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.41 145.94 54.58 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.028 -173.201 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.802 HG22 ' NZ ' ' A' ' 27' ' ' LYS . 3.3 mm -25.63 -42.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 113.623 -1.626 . . . . 0.0 111.761 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -63.45 -49.38 73.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.926 0.393 . . . . 0.0 110.051 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.613 ' N ' ' O ' ' A' ' 22' ' ' THR . 11.0 m-80 -70.66 -43.69 68.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -41.73 85.55 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.856 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.802 ' NZ ' HG22 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -60.46 -33.69 72.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.386 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.35 -41.22 85.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.843 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -60.67 -43.16 97.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.668 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.7 mt -69.57 -37.56 74.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.744 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.492 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.79 -42.24 83.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.557 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -68.45 -16.49 63.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.943 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -94.35 -42.72 8.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.828 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -106.02 -13.31 15.51 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 80.92 2.98 90.62 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.751 -0.94 . . . . 0.0 110.751 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.438 ' CG2' HD21 ' A' ' 71' ' ' LEU . 63.2 mt -77.22 115.14 46.41 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -44.89 153.39 0.42 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.753 1.635 . . . . 0.0 111.792 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.98 -24.91 14.65 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 122.236 1.957 . . . . 0.0 112.525 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.09 -22.66 52.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.203 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.546 ' O ' HD23 ' A' ' 71' ' ' LEU . 2.9 mt-30 -102.8 10.01 38.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.092 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 36' ' ' ILE . 15.2 mt-30 -100.76 140.99 34.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.798 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.478 ' HE ' HD11 ' A' ' 44' ' ' ILE . 6.3 ttt180 -131.82 120.91 23.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.416 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 44' ' ' ILE . 8.6 mt -104.71 122.05 44.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.824 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.77 139.54 38.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.159 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -147.3 133.73 19.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.572 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.73 30.98 20.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.463 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.77 -1.13 32.21 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -104.69 145.11 30.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.424 HE22 HH12 ' A' ' 72' ' ' ARG . 54.5 tt0 -84.72 140.96 30.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.499 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.8 mt -94.83 126.84 40.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -90.28 152.18 21.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.556 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 115.87 17.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.5 -34.64 1.95 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -81.92 151.33 27.3 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 44.4 p -102.35 165.1 11.31 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.06 0.457 . . . . 0.0 111.988 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 HG21 ' A' ' 61' ' ' ILE . 66.7 mt -56.33 -34.44 66.56 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.67 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -38.25 78.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.013 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -66.79 -33.34 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.056 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -86.65 -0.18 55.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.992 0.425 . . . . 0.0 110.265 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 63.83 24.88 13.9 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.462 HG21 HD22 ' A' ' 56' ' ' LEU . 9.4 mt -69.82 141.14 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.278 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -90.96 155.48 18.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.691 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.511 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -70.41 -2.0 12.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.978 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -126.73 -6.28 6.27 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.609 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.52 159.1 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.524 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -109.37 120.24 41.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.068 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.455 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.1 mp -104.25 158.69 16.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.022 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.93 121.84 45.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.122 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.0 tp -97.92 113.82 25.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.584 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.67 145.2 25.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.379 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 40' ' ' GLN . 2.9 mt -99.76 137.22 38.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.748 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.424 HH12 HE22 ' A' ' 49' ' ' GLN . 3.7 ttt85 -90.7 125.05 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.532 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.27 108.62 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.593 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -102.9 125.92 49.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.547 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 152.34 116.29 0.67 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.704 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.912 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.55 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -163.66 150.53 12.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.455 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.462 HD12 ' CD1' ' A' ' 67' ' ' LEU . 13.6 pt -108.16 172.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -119.63 137.74 53.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.104 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.6 t -124.25 114.0 39.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.884 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' CB ' ' A' ' 6' ' ' LYS . 3.2 mtpm? -100.46 135.54 41.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.902 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 p -107.18 177.1 4.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.535 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.532 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.24 -14.76 41.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.491 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.91 6.08 50.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.709 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.68 5.64 64.65 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -72.76 117.0 13.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.491 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 m -98.15 113.46 25.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.675 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -100.64 121.76 51.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.389 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.901 ' O ' HD23 ' A' ' 15' ' ' LEU . 41.8 m -97.79 129.08 44.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.898 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.901 HD23 ' O ' ' A' ' 14' ' ' THR . 1.5 mt -140.66 160.84 39.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.021 0.439 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.64 124.71 39.79 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.383 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.0 m -138.1 163.5 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.159 0.504 . . . . 0.0 112.029 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.6 mt-10 -127.08 -179.65 1.0 Allowed Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.915 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -72.84 6.2 2.57 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 121.928 1.752 . . . . 0.0 112.65 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 p -117.35 7.93 12.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.221 1.01 . . . . 0.0 109.33 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.69 48.32 1.05 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 113.247 -1.797 . . . . 0.0 109.528 178.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.71 145.57 55.5 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.111 -173.137 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.3 mm -25.76 -41.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 113.421 -1.718 . . . . 0.0 111.664 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.4 OUTLIER -63.18 -49.79 72.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.908 0.385 . . . . 0.0 110.148 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.606 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.0 t30 -70.85 -43.97 67.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.05 -42.3 94.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 13.9 mttm -60.28 -33.33 72.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.311 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.31 -36.9 74.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.576 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -61.78 -43.15 99.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.714 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.1 -37.89 78.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.458 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.506 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.02 -46.02 82.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.482 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -63.85 -16.27 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -96.55 -42.89 7.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.817 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.74 -24.28 11.77 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.856 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.06 34.18 21.77 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.471 HG21 HD21 ' A' ' 71' ' ' LEU . 30.2 mt -108.19 102.94 48.64 Favored Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' ASP . 72.9 Cg_exo -47.37 133.99 20.15 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.087 1.858 . . . . 0.0 112.579 -179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -42.55 -17.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.347 2.031 . . . . 0.0 112.839 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 37' ' ' PRO . 5.6 m-20 -69.31 -26.6 64.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.773 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.601 ' O ' HD23 ' A' ' 71' ' ' LEU . 45.0 mt-30 -112.17 10.2 20.19 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.164 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 7.6 mt-30 -104.49 132.81 50.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.907 0.384 . . . . 0.0 111.098 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.63 ' CZ ' HH22 ' A' ' 72' ' ' ARG . 2.7 mtt180 -132.34 114.4 14.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.341 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 44' ' ' ILE . 5.3 mt -97.82 120.5 38.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.733 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.638 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -116.59 143.5 26.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.29 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -147.01 134.5 20.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.432 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.57 29.56 13.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.539 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.42 -0.67 59.58 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -102.45 139.06 38.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.571 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -85.0 136.74 33.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.506 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.4 126.75 39.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -91.34 154.21 19.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.88 115.98 13.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.51 -35.84 1.77 Allowed Glycine 0 CA--C 1.527 0.841 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -82.08 151.05 27.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.779 HG22 HG22 ' A' ' 22' ' ' THR . 38.2 p -101.92 166.77 10.46 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.173 0.511 . . . . 0.0 112.038 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.431 HD22 HG21 ' A' ' 61' ' ' ILE . 63.1 mt -56.64 -35.8 68.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.575 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -38.41 75.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -62.5 -36.56 82.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.809 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -86.11 -0.67 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.935 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.417 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.5 OUTLIER 65.76 23.42 11.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.743 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.431 HG21 HD22 ' A' ' 56' ' ' LEU . 13.1 mt -66.79 145.33 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.29 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.64 164.21 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.687 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.55 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -79.5 -4.58 51.99 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.196 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -126.37 -5.1 6.61 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.418 0.449 . . . . 0.0 110.545 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 156.44 4.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.199 0.523 . . . . 0.0 111.854 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.1 m -99.37 131.55 45.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.56 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 3' ' ' ILE . 1.5 mt -111.57 141.12 45.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.895 0.379 . . . . 0.0 111.054 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -96.44 116.48 29.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.824 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.82 121.4 39.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.847 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.0 145.24 23.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.154 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 40' ' ' GLN . 12.2 mt -100.65 129.05 46.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.897 0.38 . . . . 0.0 111.051 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.63 HH22 ' CZ ' ' A' ' 42' ' ' ARG . 14.3 ttt85 -101.77 157.23 16.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.484 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 72' ' ' ARG . 3.9 mp 56.19 113.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.711 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -136.46 154.01 50.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.528 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.57 -60.05 2.04 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.77 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.92 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtp . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.7 mm-40 -48.07 158.01 0.26 Allowed 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.61 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.2 pt -150.68 172.83 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -125.13 138.27 54.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.746 0.308 . . . . 0.0 110.855 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.87 119.52 57.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.163 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -97.38 135.25 39.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.887 0.375 . . . . 0.0 110.971 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -107.49 177.71 4.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.462 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.533 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.32 -25.41 68.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.732 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.1 p -85.96 6.0 30.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.637 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.28 3.42 61.43 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -72.84 114.65 11.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.743 0.306 . . . . 0.0 110.478 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -89.23 113.61 24.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.677 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.99 122.12 46.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.416 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.87 ' O ' HD23 ' A' ' 15' ' ' LEU . 23.0 m -100.6 128.99 46.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.767 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.87 HD23 ' O ' ' A' ' 14' ' ' THR . 2.5 mt -142.05 155.15 45.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.023 0.439 . . . . 0.0 111.008 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -94.79 131.79 40.27 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.01 150.1 20.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.429 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.559 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mp0 -107.83 142.74 25.88 Favored Pre-proline 0 C--O 1.22 -0.492 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.11 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.4 ' C ' ' H ' ' A' ' 21' ' ' ASP . 97.8 Cg_exo -32.32 -37.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.607 2.205 . . . . 0.0 114.183 -179.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 p -79.08 13.42 1.8 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.943 0.878 . . . . 0.0 110.961 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.46 48.43 1.16 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.949 -1.478 . . . . 0.0 109.323 177.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.79 146.04 54.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.429 -172.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.438 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.3 mm -24.82 -39.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 113.515 -1.675 . . . . 0.0 111.948 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.1 OUTLIER -65.04 -49.83 68.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.83 0.348 . . . . 0.0 110.211 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.9 -43.94 67.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.594 179.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -40.23 83.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 38' ' ' PRO . 15.4 mttm -60.23 -32.11 70.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.193 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.68 -36.82 76.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.2 mttp -62.38 -43.21 99.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.808 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.28 -37.24 75.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.331 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 35' ' ' GLY . 23.7 tt0 -57.15 -45.41 83.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.457 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -16.74 63.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.76 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -96.61 -42.67 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.836 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -104.32 -23.83 13.17 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.938 -0.305 . . . . 0.0 111.769 -178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 85.25 14.58 68.57 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.459 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 54.3 mt -87.59 133.11 38.76 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 39' ' ' ASP . 57.3 Cg_endo -73.6 139.12 27.79 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.681 1.587 . . . . 0.0 111.838 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.502 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 76.6 Cg_exo -42.01 -21.89 0.18 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.04 1.826 . . . . 0.0 112.584 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.7 OUTLIER -71.99 -30.8 65.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.351 -179.151 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -102.1 9.81 39.97 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.845 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 56.6 mt-30 -105.48 126.26 51.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -131.9 110.26 10.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.373 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 44' ' ' ILE . 15.5 mt -95.14 121.9 37.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.569 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.62 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -114.4 144.17 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.207 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -151.6 136.96 17.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.643 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.37 27.0 5.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.584 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.74 -3.93 58.63 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -101.94 138.23 39.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.828 0.347 . . . . 0.0 110.65 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.09 138.41 32.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.435 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 mt -89.67 126.63 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.732 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -92.34 151.14 20.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.372 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 115.72 12.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.396 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.62 -36.05 1.66 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -81.8 153.05 26.65 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 45.4 p -103.86 164.26 11.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.285 0.564 . . . . 0.0 112.108 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.4 mt -56.56 -34.56 67.23 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.844 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -27.46 66.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' N ' ' OD2' ' A' ' 58' ' ' ASP . 3.5 m-20 -74.47 -29.81 61.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.237 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -94.22 15.63 16.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.672 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.4 m120 44.01 47.34 7.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.394 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.59 139.77 18.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.222 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -91.24 -177.36 4.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.064 0.459 . . . . 0.0 111.547 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.1 ptmt -85.75 -0.71 55.98 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.042 -179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' C ' ' A' ' 65' ' ' SER . 4.7 mt-10 -127.56 -12.15 5.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.251 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -32.36 127.43 0.26 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.903 -178.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.3 m -99.51 115.32 29.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.629 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.55 143.38 32.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.91 0.386 . . . . 0.0 110.754 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -96.41 124.95 40.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.985 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.73 107.59 20.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.776 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 t -106.96 145.14 14.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.472 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 38.4 mt -109.42 123.11 48.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.509 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -90.47 126.7 35.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.736 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.38 -177.32 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -126.1 143.69 51.02 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.504 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.17 158.17 27.59 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.053 -1.415 . . . . 0.0 110.92 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 63' ' ' LYS . 10.3 mt-30 -45.79 159.95 0.06 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.571 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.8 pt -150.59 173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -123.42 136.78 54.79 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.753 0.311 . . . . 0.0 111.083 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 67' ' ' LEU . 76.0 t -124.18 123.0 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.062 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -97.6 131.03 44.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.756 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 p -105.09 178.67 4.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.344 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.74 -8.79 54.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.619 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.1 p -96.24 5.1 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.2 -9.74 9.14 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 tttm -73.13 116.06 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.554 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -85.83 121.49 28.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.476 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.08 122.96 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.853 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.7 m -102.6 129.22 49.1 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.9 mt -139.37 159.78 41.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.799 0.333 . . . . 0.0 110.864 -179.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.27 128.35 42.04 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 m -142.98 149.4 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.321 -0.552 . . . . 0.0 112.25 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 28.1 mt-10 -112.9 146.4 35.02 Favored Pre-proline 0 C--O 1.222 -0.356 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.515 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -29.78 -41.18 0.07 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 123.075 2.517 . . . . 0.0 114.8 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 p -78.9 14.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.751 0.786 . . . . 0.0 111.2 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.586 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -81.66 48.22 1.16 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.375 177.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 55' ' ' THR . 0.3 OUTLIER -63.88 146.34 54.18 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.354 -172.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.452 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.9 mm -25.07 -39.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.715 -178.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' N ' ' O ' ' A' ' 22' ' ' THR . 36.9 tt0 -65.19 -52.48 54.6 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.597 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -70.65 -43.65 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.431 178.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.24 82.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.747 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HZ2' HG22 ' A' ' 23' ' ' ILE . 27.7 mttp -60.49 -32.2 71.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.977 0.418 . . . . 0.0 110.405 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.75 83.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -62.75 -43.12 99.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.667 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mt -68.07 -37.46 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 35' ' ' GLY . 17.4 tt0 -57.57 -46.21 84.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.608 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -16.46 63.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.976 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -95.97 -42.71 8.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.635 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -103.22 -23.9 13.59 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.675 -178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.91 25.75 44.1 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 53.8 mt -100.57 133.29 21.37 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 39' ' ' ASP . 60.5 Cg_endo -74.74 139.0 24.47 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.822 1.681 . . . . 0.0 111.662 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -42.44 -17.86 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 122.01 1.807 . . . . 0.0 112.553 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.5 t0 -74.75 -30.25 61.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.323 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -102.27 9.89 39.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.597 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -105.2 131.74 52.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.786 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -131.9 109.25 9.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.195 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -95.13 128.94 42.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.007 0.432 . . . . 0.0 110.689 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mt -133.95 136.54 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.291 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -135.85 140.88 44.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 55.78 18.85 3.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.648 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.11 -6.65 82.54 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -98.6 143.07 29.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.794 0.331 . . . . 0.0 110.649 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -84.93 135.89 33.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.465 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.77 126.75 35.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.734 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.78 149.89 21.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.179 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.12 115.68 11.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.465 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.24 -35.18 1.58 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -81.7 152.25 27.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.761 HG22 HG22 ' A' ' 22' ' ' THR . 44.7 p -103.75 165.22 11.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.134 0.493 . . . . 0.0 112.073 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.8 mt -56.23 -35.3 67.21 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.621 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -27.85 63.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.047 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -74.85 -31.04 61.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.132 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -91.96 14.74 14.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.952 0.406 . . . . 0.0 110.399 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 46.34 49.83 12.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.462 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.2 138.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.28 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -91.26 -177.03 4.75 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLN . 5.5 pttt -87.1 0.69 54.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.381 0.61 . . . . 0.0 111.014 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -127.47 -12.51 5.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.045 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -37.68 134.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.375 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.9 m -99.12 119.84 38.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.505 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.6 mt -103.23 141.89 35.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.908 0.385 . . . . 0.0 110.827 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -96.13 115.61 27.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -97.66 108.06 20.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.224 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.66 145.7 11.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.831 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mt -99.35 133.99 42.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.531 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.83 131.27 36.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -174.19 122.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -140.21 132.56 28.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.37 -23.53 0.24 Allowed Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.78 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.934 -179.986 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mtt . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 63' ' ' LYS . 4.8 pt20 -69.41 165.32 21.08 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.651 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.0 pt -147.07 173.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -120.17 132.86 55.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.854 0.359 . . . . 0.0 111.496 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG11 HD11 ' A' ' 30' ' ' ILE . 16.4 t -124.1 128.85 74.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.861 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.477 ' NZ ' ' OG1' ' A' ' 12' ' ' THR . 9.0 mttp -105.1 141.15 37.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 110.907 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 70.9 p -107.11 179.13 4.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 91.6 mt -70.51 -6.21 34.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.534 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 76.0 p -98.14 -1.11 42.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.18 17.06 78.8 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -93.15 121.29 34.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.772 0.32 . . . . 0.0 110.526 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.477 ' OG1' ' NZ ' ' A' ' 6' ' ' LYS . 3.5 m -89.43 113.14 24.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.08 126.58 51.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 110.736 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.895 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.0 m -101.96 129.24 48.18 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -139.7 162.33 35.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.892 0.377 . . . . 0.0 110.871 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -95.48 124.9 39.74 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 m -137.75 154.95 29.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.91 -178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.498 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.9 mm-40 -113.17 -175.78 0.34 Allowed Pre-proline 0 CA--C 1.535 0.394 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 13.5 Cg_endo -81.53 10.32 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 121.622 1.548 . . . . 0.0 112.502 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 88.8 p -118.53 6.79 11.72 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.358 1.075 . . . . 0.0 108.817 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.94 48.73 1.13 Allowed 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 112.886 -1.961 . . . . 0.0 109.199 178.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.92 146.52 53.89 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.585 -172.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.456 HG22 ' CE ' ' A' ' 27' ' ' LYS . 4.1 mm -25.03 -38.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 113.356 -1.747 . . . . 0.0 111.823 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.0 OUTLIER -67.97 -49.74 59.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.9 OUTLIER -70.67 -43.56 68.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.547 179.088 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -40.7 79.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.896 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' CE ' HG22 ' A' ' 23' ' ' ILE . 15.0 mtmt -60.43 -33.13 72.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.162 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.09 75.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.674 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -61.13 -43.12 99.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.714 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.447 HD13 HD12 ' A' ' 69' ' ' LEU . 22.7 mt -67.95 -39.2 81.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.632 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -57.12 -42.55 81.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.479 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -16.44 64.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mmtt -94.92 -42.8 8.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.658 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -103.74 -23.69 13.4 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.971 -0.291 . . . . 0.0 111.593 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 91.09 3.2 70.29 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 57.8 mt -79.63 119.55 77.23 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.23 152.19 0.44 Allowed 'Trans proline' 0 N--CA 1.49 1.275 0 C-N-CA 121.583 1.522 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.01 -25.41 14.07 Favored 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 122.318 2.012 . . . . 0.0 112.289 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 39' ' ' ASP . 14.4 t0 -76.57 -25.02 53.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.006 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.507 ' O ' HD23 ' A' ' 71' ' ' LEU . 11.7 mt-30 -94.67 9.87 37.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.945 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 36' ' ' ILE . 53.8 mt-30 -107.0 141.05 38.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.832 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' HD22 ' A' ' 43' ' ' LEU . 16.7 mtt180 -131.8 121.26 23.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.07 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.676 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mm? -94.93 123.07 38.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.723 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.676 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -119.52 139.29 47.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.99 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -149.0 143.3 26.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.602 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.9 27.47 4.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.557 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.29 -7.24 39.03 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.22 142.86 29.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 0.0 110.624 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -86.05 135.27 33.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.4 mt -89.61 126.72 35.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.768 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -87.38 150.91 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.373 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.419 ' OD2' ' N ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -74.1 115.62 13.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.457 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -36.57 1.46 Allowed Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -81.98 152.78 26.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.36 166.38 10.46 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.395 0.617 . . . . 0.0 112.398 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 mt -56.7 -34.62 67.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.802 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -27.77 63.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.915 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -74.23 -33.74 63.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.148 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -89.94 15.56 9.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 110.361 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.41 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.9 OUTLIER 43.87 54.67 5.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.31 -179.807 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -86.13 137.2 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.469 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -91.18 -176.87 4.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.617 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 2' ' ' GLN . 13.3 ptpt -89.11 5.6 43.81 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.361 0.6 . . . . 0.0 110.849 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -126.62 -12.33 6.08 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.071 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.97 131.4 2.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.316 -179.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.3 m -99.42 115.54 29.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.411 178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.39 135.1 45.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.919 0.39 . . . . 0.0 110.936 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.35 125.05 40.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.097 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.648 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.3 tt -97.79 121.44 39.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.587 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.622 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.8 t -111.51 145.46 17.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.524 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt -103.06 114.27 28.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.579 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -90.63 115.32 27.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.615 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tt -168.38 54.52 0.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.369 0.604 . . . . 0.0 110.373 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -140.58 152.19 45.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.614 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -98.02 -57.65 1.01 Allowed Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.737 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.923 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.561 ' O ' ' O ' ' A' ' 63' ' ' LYS . 28.7 tt0 64.87 82.82 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.23 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.555 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.3 pt -107.91 172.49 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -114.14 137.01 52.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.935 0.398 . . . . 0.0 111.599 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' HB2' ' A' ' 67' ' ' LEU . 99.1 t -124.79 118.02 52.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.804 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.3 mmmt -97.13 133.64 41.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.909 0.385 . . . . 0.0 110.921 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 p -107.3 178.51 4.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.484 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.61 -14.62 62.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.59 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -86.39 -5.72 59.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.673 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.99 -11.96 63.37 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -72.61 133.93 44.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.5 m -101.41 115.39 30.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.79 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -92.8 120.8 42.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.534 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.898 ' O ' HD23 ' A' ' 15' ' ' LEU . 14.4 m -98.9 128.77 45.16 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.898 HD23 ' O ' ' A' ' 14' ' ' THR . 1.3 mt -140.35 157.83 44.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.397 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.426 ' HA ' ' H ' ' A' ' 2' ' ' GLN . 8.3 tt0 -94.07 127.72 40.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.88 153.16 24.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.885 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.6 mm-40 -116.07 -179.67 0.66 Allowed Pre-proline 0 C--O 1.222 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.009 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.7 Cg_exo -71.75 6.09 2.18 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 121.853 1.702 . . . . 0.0 112.705 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.9 p -117.73 7.3 12.48 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 122.229 1.014 . . . . 0.0 109.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.71 48.62 1.09 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.356 -1.747 . . . . 0.0 109.74 178.791 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.83 146.71 53.45 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.032 -173.208 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.694 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.1 -30.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 113.334 -1.757 . . . . 0.0 111.579 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 22' ' ' THR . 2.4 tt0 -69.68 -51.02 38.35 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.588 ' N ' ' O ' ' A' ' 22' ' ' THR . 12.8 m120 -71.02 -44.15 66.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.702 179.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.84 83.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.72 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.61 -34.33 74.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.8 -43.12 76.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.731 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -60.78 -41.3 95.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.602 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.86 -40.84 81.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.623 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.7 OUTLIER -57.12 -44.33 83.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.395 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -16.67 64.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -96.72 -42.62 7.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.721 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -103.59 -24.09 13.43 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.815 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.18 31.46 28.32 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.416 ' CG2' HD21 ' A' ' 71' ' ' LEU . 51.6 mt -100.09 132.75 22.24 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.6 Cg_endo -74.5 119.62 5.83 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.966 1.777 . . . . 0.0 112.241 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -44.2 -16.33 0.1 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.966 1.777 . . . . 0.0 112.516 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.472 ' N ' ' O ' ' A' ' 37' ' ' PRO . 24.5 t0 -65.01 -33.23 75.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.377 -179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -112.26 -21.33 11.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.947 0.403 . . . . 0.0 110.505 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.7 tt0 -57.24 134.06 55.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.931 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.672 ' NH1' HE21 ' A' ' 49' ' ' GLN . 8.7 ttt180 -132.07 131.46 42.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.591 ' C ' HD12 ' A' ' 44' ' ' ILE . 77.2 mt -111.87 119.81 39.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.1 142.67 24.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.181 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.2 t80 -145.53 120.54 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.598 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 67.57 31.74 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.464 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.06 -9.07 20.17 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -95.27 143.06 26.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.858 0.361 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.672 HE21 ' NH1' ' A' ' 42' ' ' ARG . 0.8 OUTLIER -85.43 138.06 32.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.511 -179.955 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 43.1 mt -94.56 153.98 17.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.708 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.74 154.0 45.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.387 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.8 149.44 46.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.437 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 111.47 -35.2 4.86 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.741 -0.943 . . . . 0.0 110.741 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -89.28 147.1 24.3 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.597 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 22' ' ' THR . 33.0 p -103.25 168.91 8.87 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.308 0.575 . . . . 0.0 111.982 -179.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 HG21 ' A' ' 61' ' ' ILE . 72.9 mt -56.81 -34.45 67.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.35 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.98 -31.19 67.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.891 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -73.4 -37.16 66.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.884 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -84.03 3.25 35.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.079 0.466 . . . . 0.0 109.889 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.94 26.84 16.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.636 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.461 HG21 HD22 ' A' ' 56' ' ' LEU . 11.3 mt -69.31 142.67 15.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.202 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -90.79 -177.45 4.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.116 0.484 . . . . 0.0 111.221 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 2' ' ' GLN . 9.7 pttt -90.78 -6.7 54.0 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.117 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -125.68 -4.32 7.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.949 0.404 . . . . 0.0 110.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -47.79 163.07 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.354 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.06 119.5 39.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.974 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.431 ' HB2' HG22 ' A' ' 5' ' ' VAL . 4.8 mt -103.98 135.16 46.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.754 0.312 . . . . 0.0 110.972 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.49 132.51 41.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.547 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.635 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -104.37 119.94 40.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.533 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.633 ' N ' HD23 ' A' ' 69' ' ' LEU . 1.6 t -128.57 141.64 46.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.115 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.416 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.8 mt -104.39 140.76 37.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.68 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -90.57 144.01 26.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.41 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.15 138.73 7.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -131.01 128.03 39.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.534 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.8 -33.13 86.43 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.715 0 CA-C-O 118.045 -1.419 . . . . 0.0 110.971 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.556 ' O ' ' O ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.49 135.63 38.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.568 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.1 pt -107.79 172.51 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -119.36 140.03 51.01 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.966 0.412 . . . . 0.0 111.689 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.444 HG22 ' HB2' ' A' ' 67' ' ' LEU . 43.5 t -124.88 124.24 67.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.589 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.4 137.2 36.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.883 0.373 . . . . 0.0 110.974 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.0 p -107.17 178.71 4.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.38 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.92 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -68.8 -20.86 64.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.243 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.6 p -87.63 4.9 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.597 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.97 0.64 70.21 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -72.47 132.79 44.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.839 0.352 . . . . 0.0 110.511 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 m -101.6 116.23 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.65 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.91 123.76 48.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.446 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.887 ' O ' HD23 ' A' ' 15' ' ' LEU . 3.8 m -101.74 129.3 47.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.06 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.887 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -140.24 157.98 44.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.661 -179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -94.79 127.39 40.76 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 m -138.87 148.92 23.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.536 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 76.8 mt-10 -117.4 145.3 35.78 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.058 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.447 ' C ' ' H ' ' A' ' 21' ' ' ASP . 78.1 Cg_exo -29.02 -39.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 123.182 2.588 . . . . 0.0 114.714 -178.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.5 p -79.04 16.05 1.0 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.884 0.85 . . . . 0.0 110.93 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.536 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -82.09 48.11 1.21 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.908 178.323 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.28 146.53 54.21 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.885 0.85 . . . . 0.0 110.905 -173.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.704 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.58 -30.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.69 -177.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 22' ' ' THR . 61.2 tt0 -69.92 -49.8 48.41 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.7 OUTLIER -71.11 -43.85 66.84 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.674 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.95 83.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.823 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -60.33 -32.25 71.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.423 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.43 81.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.743 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 mttm -61.81 -43.19 99.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.4 mt -68.6 -38.97 79.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.508 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.672 ' N ' HE22 ' A' ' 41' ' ' GLN . 0.2 OUTLIER -58.46 -45.81 87.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.52 -16.42 63.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -95.5 -42.68 8.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.821 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -104.91 -24.01 12.91 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.795 -178.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 83.43 31.57 27.35 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.505 -1.038 . . . . 0.0 110.505 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' ' NE2' ' A' ' 41' ' ' GLN . 65.9 mt -102.09 105.29 41.56 Favored Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.526 ' O ' ' N ' ' A' ' 39' ' ' ASP . 73.4 Cg_exo -46.29 138.78 13.07 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.778 1.652 . . . . 0.0 111.785 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -42.1 -16.87 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.106 1.87 . . . . 0.0 112.556 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -75.28 -30.58 60.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.223 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -102.63 10.34 38.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.526 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.672 HE22 ' N ' ' A' ' 31' ' ' GLN . 37.1 mt-30 -102.76 123.52 46.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.677 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.516 ' NH1' ' OE1' ' A' ' 49' ' ' GLN . 3.3 ttt180 -132.12 115.84 16.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.465 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 72.8 mt -98.0 119.84 37.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.549 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -113.53 141.74 28.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.12 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -151.59 134.35 15.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.632 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 30.08 17.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 72.17 -4.52 17.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -102.45 144.25 31.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.79 0.328 . . . . 0.0 110.429 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.516 ' OE1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 tt0 -84.96 136.01 33.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.486 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.4 mt -89.36 153.93 20.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.789 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -122.45 154.27 38.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.478 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.56 131.01 41.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.527 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 129.28 -33.55 3.0 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.554 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -88.52 148.17 24.27 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.561 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 36.4 p -102.67 167.35 9.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.094 0.473 . . . . 0.0 111.912 -179.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.45 HD22 HG21 ' A' ' 61' ' ' ILE . 80.1 mt -56.64 -35.4 68.31 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.498 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.94 -27.51 63.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.7 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -75.89 -36.53 59.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.287 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -85.85 -0.51 55.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 110.231 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 69.04 19.09 8.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.45 HG21 HD22 ' A' ' 56' ' ' LEU . 20.9 mt -64.14 144.21 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.484 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -90.83 -177.4 4.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.763 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 2' ' ' GLN . 7.0 ptpt -92.68 -7.01 48.0 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.113 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -125.17 -5.19 7.31 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.473 0.483 . . . . 0.0 110.42 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.5 m -49.53 156.95 0.58 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.485 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.8 m -105.11 122.76 46.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.87 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.444 ' HB2' HG22 ' A' ' 5' ' ' VAL . 3.4 mt -103.89 147.14 27.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.83 0.348 . . . . 0.0 110.652 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -99.77 119.3 37.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.165 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -97.93 116.26 29.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.622 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.68 145.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.605 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.0 mt -99.34 143.75 29.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.98 154.33 47.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.882 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.5 mt 56.73 97.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.478 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -106.81 137.49 44.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.548 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.6 -61.34 6.33 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.733 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.879 -179.894 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.471 ' O ' ' CB ' ' A' ' 2' ' ' GLN . 10.2 ttm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.575 ' O ' ' O ' ' A' ' 63' ' ' LYS . 20.6 tt0 81.47 80.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.545 HG22 ' C ' ' A' ' 63' ' ' LYS . 3.9 pt -108.42 171.63 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.85 137.85 50.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.145 0.498 . . . . 0.0 111.832 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -124.42 127.71 73.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.324 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.21 138.64 34.38 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.189 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.597 ' CG2' HD11 ' A' ' 13' ' ' ILE . 37.8 p -107.44 174.65 5.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.463 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.7 -15.65 62.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.454 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 38.6 p -91.84 -3.93 55.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.634 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.83 -4.33 85.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.5 tttp -74.01 121.92 21.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.701 0.286 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 m -88.12 118.17 27.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.597 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.0 OUTLIER -97.83 122.67 49.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.878 ' O ' HD23 ' A' ' 15' ' ' LEU . 29.1 m -98.74 129.51 45.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.878 HD23 ' O ' ' A' ' 14' ' ' THR . 1.2 mt -139.78 155.91 47.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.528 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -93.72 130.2 39.77 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.96 161.48 20.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.235 0.541 . . . . 0.0 112.443 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.547 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.4 mt-10 -122.03 -179.02 0.69 Allowed Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.596 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -74.75 7.16 2.88 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 121.81 1.673 . . . . 0.0 112.711 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 p -118.65 8.22 11.88 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.322 1.058 . . . . 0.0 109.293 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.547 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.7 48.24 1.05 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.09 -1.868 . . . . 0.0 109.392 178.751 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.1 146.49 54.1 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.956 -173.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.69 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -29.73 -31.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 113.315 -1.766 . . . . 0.0 111.514 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.5 tp10 -69.52 -50.57 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 16.7 m120 -71.14 -43.97 66.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.627 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.79 83.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.675 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.528 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 19.6 mttm -60.32 -32.27 71.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.07 -45.08 71.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.773 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -60.63 -42.61 97.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.559 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.63 -39.72 82.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.608 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.6 OUTLIER -57.28 -44.57 84.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -65.79 -16.78 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.785 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -96.86 -42.86 7.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.72 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -102.86 -23.98 13.72 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 81.58 34.84 24.29 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.593 ' CG2' HD21 ' A' ' 71' ' ' LEU . 73.1 mt -106.55 99.95 27.66 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.827 -0.13 . . . . 0.0 110.756 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.53 ' O ' ' N ' ' A' ' 39' ' ' ASP . 78.1 Cg_exo -48.26 122.59 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.915 1.743 . . . . 0.0 112.085 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -44.36 -12.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.058 1.839 . . . . 0.0 112.465 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 37' ' ' PRO . 8.6 t70 -64.98 -33.56 76.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.538 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -112.47 -22.41 10.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.964 0.411 . . . . 0.0 110.513 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 1.5 tt0 -55.69 133.15 50.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.026 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 70' ' ' VAL . 3.6 ttt180 -132.21 121.1 23.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.257 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.614 ' C ' HD12 ' A' ' 44' ' ' ILE . 3.9 mt -102.11 120.01 39.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.736 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.614 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.28 145.13 21.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.181 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 92.1 t80 -154.64 127.26 8.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.586 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 48' ' ' LYS . . . 65.17 40.52 4.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.489 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 61.63 -0.25 1.64 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.473 ' H ' ' C ' ' A' ' 46' ' ' ALA . 0.4 OUTLIER -105.14 141.73 36.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.816 0.341 . . . . 0.0 110.408 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -86.34 134.52 33.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.533 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 24.4 mt -89.57 154.12 20.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.504 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -124.18 154.59 39.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.42 121.3 21.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.461 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.17 -33.87 2.05 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -90.28 148.02 23.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.772 HG22 HG22 ' A' ' 22' ' ' THR . 34.3 p -101.96 169.77 8.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.251 0.548 . . . . 0.0 112.118 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.73 -35.64 68.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.524 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -28.81 64.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.114 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -76.37 -34.19 58.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.183 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -87.8 12.99 11.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.908 0.385 . . . . 0.0 110.046 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.511 ' N ' HD22 ' A' ' 60' ' ' ASN . 1.0 OUTLIER 49.89 44.23 25.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.734 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.7 143.72 11.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.206 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -90.94 176.72 6.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.563 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.575 ' O ' ' O ' ' A' ' 2' ' ' GLN . 14.5 ptpt -85.06 -6.52 59.32 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.854 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -125.16 -5.53 7.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.928 0.394 . . . . 0.0 110.386 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.8 m -44.41 154.17 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.289 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -108.53 124.58 50.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.071 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 mt -104.04 157.44 17.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.79 0.328 . . . . 0.0 110.896 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -114.47 121.96 45.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.134 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.639 ' C ' HD23 ' A' ' 69' ' ' LEU . 5.7 tt -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.728 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.637 ' N ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -128.33 140.1 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.234 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.593 HD21 ' CG2' ' A' ' 36' ' ' ILE . 3.4 mt -106.55 115.7 30.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.81 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.0 tmm_? -93.25 124.97 37.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.354 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.455 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.4 tt -148.22 99.38 3.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.582 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.7 mtp85 -105.25 129.14 53.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.482 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 55.6 -142.87 36.49 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.724 0 CA-C-O 117.932 -1.482 . . . . 0.0 111.013 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.593 ' NE2' ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -129.57 136.09 49.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.353 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 pt -107.88 172.14 2.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -116.38 139.17 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.937 0.399 . . . . 0.0 111.566 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -125.17 114.3 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.566 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -97.53 130.5 44.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.848 0.356 . . . . 0.0 111.079 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.4 p -107.41 178.53 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.464 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -63.23 -22.33 66.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.604 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -86.14 6.17 30.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.788 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.07 -0.08 17.53 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -72.84 110.68 7.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.29 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -86.31 113.31 22.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.447 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.96 123.85 49.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.737 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.894 ' O ' HD23 ' A' ' 15' ' ' LEU . 27.1 m -99.78 128.99 45.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.894 HD23 ' O ' ' A' ' 14' ' ' THR . 1.6 mt -140.13 162.06 36.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.874 0.369 . . . . 0.0 110.852 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -95.34 129.37 42.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.74 152.29 19.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.987 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -116.92 -179.4 0.63 Allowed Pre-proline 0 C--O 1.222 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.817 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 3.4 Cg_exo -71.5 7.6 1.48 Allowed 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.8 1.666 . . . . 0.0 112.393 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 p -118.62 6.79 11.65 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 122.199 0.999 . . . . 0.0 109.638 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -80.45 48.48 1.04 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 113.298 -1.774 . . . . 0.0 109.598 178.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -64.27 146.41 54.4 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-O 122.029 0.918 . . . . 0.0 111.276 -172.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.698 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -30.45 -30.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 113.319 -1.764 . . . . 0.0 111.781 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' THR . 27.7 tt0 -69.94 -48.62 57.7 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.589 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t-20 -70.84 -43.92 67.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.477 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.4 83.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.743 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -60.33 -37.15 79.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.273 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.29 -38.57 75.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -60.57 -39.69 88.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.539 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.6 -39.59 70.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.568 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -57.08 -42.78 81.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.56 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.726 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -94.54 -42.88 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.578 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -108.27 -0.86 20.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 66.84 3.39 21.68 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.2 mt -78.02 117.98 69.33 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -44.66 152.35 0.5 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.673 1.582 . . . . 0.0 112.037 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.48 -25.98 12.48 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.386 2.057 . . . . 0.0 112.525 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -8.67 57.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.366 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.798 ' O ' HD23 ' A' ' 71' ' ' LEU . 9.0 mt-30 -109.64 10.01 24.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.185 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -112.6 142.15 45.53 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.882 0.372 . . . . 0.0 110.838 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.796 ' HE ' ' HE ' ' A' ' 72' ' ' ARG . 3.7 mtt180 -131.82 119.63 21.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.335 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -95.21 137.12 34.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -134.1 144.54 35.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.261 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -154.07 148.18 25.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.409 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 54.93 24.44 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.501 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.34 -0.14 64.83 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -106.16 146.86 29.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.423 HE22 ' NH2' ' A' ' 42' ' ' ARG . 43.5 tt0 -85.08 139.38 31.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.507 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mt -93.02 154.09 18.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.684 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -123.04 151.1 42.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.443 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.38 123.93 22.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 134.83 -34.31 2.35 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 mmt-85 -86.47 147.16 26.11 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.769 HG22 HG22 ' A' ' 22' ' ' THR . 34.2 p -102.54 168.17 9.46 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.175 0.512 . . . . 0.0 111.983 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 61' ' ' ILE . 74.7 mt -56.65 -34.3 67.18 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.565 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -32.99 70.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.037 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -71.74 -37.39 70.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.124 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -83.27 0.74 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.072 0.463 . . . . 0.0 109.908 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.576 ' N ' ' ND2' ' A' ' 60' ' ' ASN . 0.3 OUTLIER 63.08 28.14 16.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.745 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.433 HG21 HD22 ' A' ' 56' ' ' LEU . 12.9 mt -70.91 144.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.157 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -90.47 -179.14 5.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.551 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -92.03 -5.33 53.11 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.123 -179.467 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -126.4 -1.1 6.93 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 123.464 0.478 . . . . 0.0 110.39 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.4 m -52.51 167.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.787 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.7 m -117.21 119.33 34.86 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.904 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.0 mt -104.26 147.83 27.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.824 0.345 . . . . 0.0 111.036 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -101.75 149.19 24.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.653 ' C ' HD23 ' A' ' 69' ' ' LEU . 6.2 tt -124.61 122.29 37.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.973 0.416 . . . . 0.0 111.091 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.64 ' N ' HD23 ' A' ' 69' ' ' LEU . 3.1 t -115.83 145.6 21.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.961 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 40' ' ' GLN . 4.7 mt -99.94 114.52 27.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.985 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.796 ' HE ' ' HE ' ' A' ' 42' ' ' ARG . 10.0 ttm180 -103.5 142.03 34.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.388 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.94 107.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.559 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -101.95 137.05 40.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.574 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 162.0 -62.41 0.28 Allowed Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.924 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.485 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpp? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.532 ' O ' ' O ' ' A' ' 63' ' ' LYS . 8.9 pt20 -171.1 148.7 2.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.762 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.75 172.44 2.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -117.33 138.52 51.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.104 0.478 . . . . 0.0 111.512 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 52.6 t -124.52 127.51 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.592 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.615 ' NZ ' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -97.44 141.49 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.983 0.421 . . . . 0.0 111.247 -179.117 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 38.6 p -107.36 172.94 6.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.302 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.83 -16.06 62.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.218 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -89.75 -13.65 36.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.548 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.52 -4.07 56.56 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -73.28 127.34 32.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.83 0.348 . . . . 0.0 110.704 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.3 m -95.6 120.22 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.535 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -99.5 124.37 52.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.819 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.89 ' O ' HD23 ' A' ' 15' ' ' LEU . 73.6 m -103.59 128.93 50.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.762 179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.89 HD23 ' O ' ' A' ' 14' ' ' THR . 1.7 mt -141.38 159.94 41.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.958 0.409 . . . . 0.0 110.953 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -137.25 145.87 28.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.354 0.597 . . . . 0.0 112.373 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.584 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 0.4 OUTLIER -108.6 150.09 40.26 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.371 178.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -35.13 -38.82 0.19 Allowed 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.456 2.104 . . . . 0.0 113.857 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 p -79.14 13.34 1.86 Allowed 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.657 0.741 . . . . 0.0 111.466 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.584 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.9 OUTLIER -80.93 48.56 1.11 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.613 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.62 145.89 54.82 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.186 -0.916 . . . . 0.0 111.241 -173.042 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.453 ' N ' HD13 ' A' ' 23' ' ' ILE . 3.8 mm -25.75 -39.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 113.459 -1.7 . . . . 0.0 111.763 -178.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' THR . 41.8 tt0 -66.0 -49.79 66.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.165 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 0.2 OUTLIER -70.8 -43.78 67.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.576 179.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.39 -41.67 94.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.994 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 15.0 mttm -60.37 -32.62 71.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.486 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.67 -36.98 83.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.75 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -66.32 -43.15 87.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.821 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.18 -37.58 79.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.537 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 35' ' ' GLY . 6.7 tt0 -57.22 -47.03 82.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.678 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -16.61 64.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.1 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -94.7 -42.8 8.57 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.745 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -104.15 -23.87 13.23 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.677 -178.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 84.14 24.66 47.33 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -95.9 133.18 25.74 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.517 ' O ' ' N ' ' A' ' 39' ' ' ASP . 58.3 Cg_endo -74.16 126.89 10.83 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 121.822 1.681 . . . . 0.0 111.803 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.44 -14.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 37' ' ' PRO . 3.6 m-20 -71.96 -22.51 61.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.303 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -112.2 -22.19 11.08 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.964 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.514 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.4 mt-30 -63.89 130.99 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.817 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.606 HH11 ' NE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -132.42 111.42 11.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.351 179.586 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.65 ' C ' HD12 ' A' ' 44' ' ' ILE . 51.6 mt -95.15 120.9 36.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.625 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.65 HD12 ' C ' ' A' ' 43' ' ' LEU . 1.7 mp -115.84 126.31 73.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.192 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 91.1 t80 -136.19 122.63 20.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.538 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 71.84 27.5 2.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.449 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.79 -7.75 25.52 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 3.0 ttpm? -99.57 142.96 30.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 0.0 110.406 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -85.06 140.52 30.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.427 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.7 mt -94.63 126.89 40.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.717 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -91.93 152.57 19.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.333 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.56 115.92 14.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.617 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.68 -34.57 1.79 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -83.02 151.83 25.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.774 HG22 HG22 ' A' ' 22' ' ' THR . 43.7 p -102.91 166.82 10.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 112.113 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.42 HD22 HG21 ' A' ' 61' ' ' ILE . 67.8 mt -56.44 -34.59 66.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.393 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -38.16 73.46 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.884 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -63.9 -37.13 86.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.792 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.09 -0.54 54.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.981 0.42 . . . . 0.0 109.982 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 63.98 27.31 14.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.42 HG21 HD22 ' A' ' 56' ' ' LEU . 13.8 mt -69.47 145.03 13.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.237 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -90.74 163.38 14.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.913 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -78.77 -4.39 49.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.96 -179.716 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -126.12 -6.55 6.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.313 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.6 163.27 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.705 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.615 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 58.7 m -110.95 136.67 49.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.959 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -117.55 160.21 21.62 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.863 0.363 . . . . 0.0 111.077 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -117.4 127.14 53.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.312 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 70' ' ' VAL . 5.9 tt -102.57 121.79 43.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.763 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.647 ' N ' HD23 ' A' ' 69' ' ' LEU . 2.9 t -125.88 145.63 33.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.495 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.2 mt -100.95 143.81 30.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.676 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.606 ' NE ' HH11 ' A' ' 42' ' ' ARG . 0.9 OUTLIER -93.91 120.27 33.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.506 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.38 101.46 3.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.46 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.22 141.87 51.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.631 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.7 -20.05 25.42 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.785 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.982 -179.973 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtp . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.5 ' O ' ' O ' ' A' ' 63' ' ' LYS . 13.6 mt-30 -96.38 164.17 12.75 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.7 pt -150.5 173.72 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -124.52 135.02 52.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.628 0.252 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 67' ' ' LEU . 89.8 t -122.18 114.33 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.109 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' CB ' ' NZ ' ' A' ' 6' ' ' LYS . 2.3 mtpm? -97.89 129.94 44.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.873 0.368 . . . . 0.0 110.881 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -104.68 178.74 4.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.465 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.7 mm? -62.04 -22.81 66.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.587 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.06 5.98 31.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.765 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.57 1.46 37.38 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.104 -0.799 . . . . 0.0 111.104 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 tttm -73.09 113.44 10.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.802 0.334 . . . . 0.0 110.525 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.2 m -89.31 113.15 24.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.22 123.07 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.55 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.897 ' O ' HD23 ' A' ' 15' ' ' LEU . 1.2 m -103.15 129.11 49.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.839 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.897 HD23 ' O ' ' A' ' 14' ' ' THR . 1.8 mt -139.65 161.63 37.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.58 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -95.23 124.82 39.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.6 m -138.19 155.09 28.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 121.129 0.49 . . . . 0.0 111.824 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' CD ' ' N ' ' A' ' 18' ' ' GLU . 1.5 mm-40 -113.36 -176.28 0.37 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.104 179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 11.1 Cg_endo -80.99 9.31 3.87 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 121.669 1.579 . . . . 0.0 112.567 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.6 p -118.37 6.2 11.84 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.429 1.109 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.92 48.91 1.15 Allowed 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 112.839 -1.982 . . . . 0.0 109.341 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER -63.9 145.95 54.9 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.607 -172.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.44 ' N ' HD13 ' A' ' 23' ' ' ILE . 4.2 mm -24.23 -40.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 113.326 -1.761 . . . . 0.0 111.843 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 22' ' ' THR . 3.3 tm-20 -63.78 -51.3 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.856 0.36 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.603 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.7 t30 -70.78 -43.81 67.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.645 179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.33 87.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.748 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.519 ' NZ ' ' O ' ' A' ' 41' ' ' GLN . 32.2 mttm -60.53 -32.15 71.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.76 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.12 79.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.816 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -66.2 -37.25 79.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.484 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.96 -34.66 75.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.708 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -16.72 60.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.768 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -96.58 -42.73 7.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.553 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -103.36 -2.7 26.62 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.618 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.7 3.24 26.54 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 111.145 -0.782 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.426 HG21 HD21 ' A' ' 71' ' ' LEU . 62.4 mt -77.7 134.31 65.41 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.02 152.15 76.97 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.56 1.507 . . . . 0.0 111.616 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -68.83 -21.1 38.59 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.165 1.91 . . . . 0.0 112.394 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -71.13 -32.05 68.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.194 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.617 ' O ' HD23 ' A' ' 71' ' ' LEU . 21.0 mt-30 -100.05 10.0 41.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.058 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.519 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 45.8 mt-30 -88.39 137.15 32.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 110.768 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.15 105.85 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.448 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.1 mt -97.17 128.88 44.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.929 0.395 . . . . 0.0 110.409 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -130.8 136.57 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.477 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.516 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 72.7 t80 -138.52 120.67 15.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 45' ' ' PHE . . . 70.09 32.48 2.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.07 -3.21 47.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.449 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 2.7 ttpm? -102.66 138.91 38.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.8 0.333 . . . . 0.0 110.452 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.44 139.05 31.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.541 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -91.91 126.63 37.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -89.26 150.11 22.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.277 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.37 115.59 11.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.413 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.77 -36.54 1.42 Allowed Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.99 152.51 26.66 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.768 HG22 HG22 ' A' ' 22' ' ' THR . 43.3 p -103.53 165.0 11.3 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.412 0.625 . . . . 0.0 112.025 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 mt -56.78 -34.38 67.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.759 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -27.88 64.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.982 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.44 -34.92 68.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.146 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -87.5 11.77 13.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.0 110.251 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.533 ' N ' HD22 ' A' ' 60' ' ' ASN . 1.3 m120 50.17 39.46 19.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.64 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.26 138.68 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.354 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -91.18 -177.15 4.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.983 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.5 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.1 OUTLIER -87.95 0.25 56.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.9 -179.69 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -127.56 -11.31 5.62 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.214 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -37.98 135.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.288 -179.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 m -98.99 118.64 36.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.419 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.479 ' HB2' HG22 ' A' ' 5' ' ' VAL . 1.3 mt -103.32 139.76 38.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.839 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -95.89 117.14 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.874 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.62 102.32 14.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.307 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.89 144.16 16.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 40' ' ' GLN . 3.2 mt -100.45 127.04 46.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.58 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' C ' HD12 ' A' ' 73' ' ' LEU . 5.2 ttt180 -91.58 114.63 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.781 ' N ' HD12 ' A' ' 73' ' ' LEU . 5.1 mp -95.87 165.37 12.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.481 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -102.81 154.12 19.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.619 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.82 -125.99 1.0 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.649 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.904 -179.959 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.586 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.538 ' O ' ' O ' ' A' ' 63' ' ' LYS . 5.7 pt20 -164.69 151.27 10.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.564 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.4 pt -108.21 172.76 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -118.46 139.07 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.753 0.311 . . . . 0.0 111.598 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.453 HG22 ' HB2' ' A' ' 67' ' ' LEU . 40.5 t -125.59 114.83 41.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.617 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -97.91 134.23 41.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.941 0.4 . . . . 0.0 111.045 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 p -104.03 177.14 4.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.221 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.553 HD11 HG13 ' A' ' 70' ' ' VAL . 10.5 mt -70.81 -9.08 56.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.499 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.31 -3.1 55.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.617 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.17 88.73 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -81.77 129.57 34.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.857 0.361 . . . . 0.0 110.546 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 m -103.36 113.4 26.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.48 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -92.67 126.27 45.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.489 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.873 ' O ' HD23 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -104.6 128.93 52.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.835 179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.873 HD23 ' O ' ' A' ' 14' ' ' THR . 2.9 mt -144.45 160.87 40.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.975 0.417 . . . . 0.0 111.016 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.3 129.92 42.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -142.68 153.01 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.088 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.479 ' H ' ' CG ' ' A' ' 21' ' ' ASP . 1.8 mm-40 -115.96 -178.88 0.56 Allowed Pre-proline 0 C--O 1.221 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.664 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 18' ' ' GLU . 6.2 Cg_exo -72.76 6.51 2.38 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.788 1.659 . . . . 0.0 112.612 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.1 p -117.29 7.49 12.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.207 1.003 . . . . 0.0 109.394 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' CG ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -80.55 48.45 1.05 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 113.306 -1.77 . . . . 0.0 109.658 178.799 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -63.9 146.54 53.82 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.042 0.925 . . . . 0.0 111.033 -173.285 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.702 ' H ' ' CD1' ' A' ' 23' ' ' ILE . 1.7 mp -31.04 -30.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 113.327 -1.76 . . . . 0.0 111.525 -177.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.544 ' N ' ' O ' ' A' ' 22' ' ' THR . 23.3 tt0 -70.07 -49.35 51.9 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' A' ' 22' ' ' THR . 1.3 t-20 -71.08 -44.03 66.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.66 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.48 82.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.624 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -60.51 -32.1 71.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.413 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.15 -36.81 75.0 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.769 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -66.3 -43.22 86.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.769 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.21 -37.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.488 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.473 ' O ' ' N ' ' A' ' 35' ' ' GLY . 4.9 tt0 -56.98 -47.24 81.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.621 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.31 -16.71 64.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.147 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -92.89 -42.63 9.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.516 -179.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.17 -23.87 13.61 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.4 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 31' ' ' GLN . . . 89.49 10.51 65.45 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 47.5 mt -85.99 132.74 42.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 39' ' ' ASP . 59.9 Cg_endo -74.62 141.79 28.31 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 121.839 1.693 . . . . 0.0 111.861 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -42.61 -16.15 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 122.058 1.839 . . . . 0.0 112.423 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' N ' ' O ' ' A' ' 37' ' ' PRO . 27.6 m-20 -76.89 -31.94 57.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.288 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -103.47 9.78 37.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.711 0.291 . . . . 0.0 110.893 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -98.92 128.42 45.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -131.94 115.74 16.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 43' ' ' LEU . 45.7 mt -100.52 130.45 46.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.663 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.4 mt -133.02 122.32 45.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.252 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' A' ' 46' ' ' ALA . 49.6 t80 -102.1 -108.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.046 0.45 . . . . 0.0 110.453 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.606 ' N ' ' CG ' ' A' ' 45' ' ' PHE . . . -62.58 69.29 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' PHE . . . 45.62 19.67 0.31 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' C ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -126.82 149.05 49.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.693 0.282 . . . . 0.0 110.574 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -84.85 138.02 32.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.379 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -92.42 154.2 18.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.043 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -114.46 154.43 28.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.508 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.31 117.07 17.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.513 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 141.96 -30.34 2.16 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.436 ' CD ' ' N ' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -89.83 147.2 23.93 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.759 HG22 HG22 ' A' ' 22' ' ' THR . 31.8 p -102.73 167.81 9.65 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.325 0.583 . . . . 0.0 112.074 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.491 HD22 HG21 ' A' ' 61' ' ' ILE . 75.3 mt -56.71 -34.67 67.68 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.442 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -27.87 63.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.885 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -76.28 -36.36 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.091 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.12 1.6 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.986 0.422 . . . . 0.0 110.108 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 66.23 21.64 11.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.491 HG21 HD22 ' A' ' 56' ' ' LEU . 18.3 mt -67.52 143.19 15.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.26 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -91.03 174.92 7.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.671 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.538 ' O ' ' O ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -87.54 -3.72 58.99 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.991 -179.634 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -126.67 -3.14 6.64 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.514 0.509 . . . . 0.0 110.418 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.47 171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.91 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.4 m -120.61 117.96 28.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.834 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.453 ' HB2' HG22 ' A' ' 5' ' ' VAL . 2.3 mt -104.14 155.77 18.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.688 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -108.36 121.05 44.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.149 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.24 108.81 21.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.494 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.553 HG13 HD11 ' A' ' 8' ' ' LEU . 1.8 t -114.05 144.99 20.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.524 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.0 mt -99.86 121.24 41.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.58 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -94.01 125.74 38.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.599 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.406 ' C ' HD23 ' A' ' 73' ' ' LEU . 1.2 tt -162.36 101.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.14 134.06 29.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.567 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -86.22 -44.6 5.88 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.73 0 CA-C-O 117.973 -1.459 . . . . 0.0 110.958 179.97 . . . . . . . . 0 0 . 1 stop_ save_