data_2k1n_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 2k1n _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 111.901 -0.48 . . . . 3.69 111.901 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.417 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 5.18 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.64 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.86 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 3.36 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 3.49 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.44 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.79 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.91 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.4 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.406 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 4.19 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.75 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.521 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.95 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.73 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.93 113.449 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.415 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 4.13 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.31 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 4.1 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.526 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 3.29 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 4.15 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.55 111.035 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.96 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.81 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.53 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 5.43 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.43 111.671 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.49 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.526 ' O ' HG23 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 3.39 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 3.37 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.51 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.87 110.002 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.41 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.43 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.68 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.28 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.57 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 3.37 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.6 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.51 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.58 110.175 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.79 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.58 108.969 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.69 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 5.07 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.51 112.329 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 7.13 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.78 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 6.49 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.57 110.424 179.735 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.463 -0.655 . . . . 4.11 111.463 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . 0.406 ' CG2' ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.85 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 4.04 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.472 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.88 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.62 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 4.11 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.52 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.89 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 4.23 110.376 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . 0.526 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.75 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 4.22 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.5 108.096 177.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 3.46 112.247 -178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.95 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.61 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . 0.472 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.81 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.74 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 4.02 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 4.46 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 5.09 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.85 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 5.35 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 4.09 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.49 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.89 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.56 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.96 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 2.71 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.95 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.12 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.417 ' HB ' ' HB ' ' A' ' 6' ' ' ILE . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.79 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.46 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.65 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.8 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.74 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.38 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 4.18 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.86 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.82 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.46 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 3.18 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.95 110.715 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.67 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 4.11 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.3 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.48 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 4.18 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.44 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.43 110.329 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.069 -0.715 . . . . 5.01 109.069 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.42 110.354 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.54 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 4.61 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.98 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 4.0 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 3.28 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 3.27 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.57 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.77 111.037 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.24 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' D' ' 16' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.35 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . 0.412 ' HB ' ' H ' ' C' ' 17' ' ' VAL . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 3.02 111.86 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.412 ' H ' ' HB ' ' C' ' 16' ' ' VAL . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.81 111.362 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.72 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.71 112.579 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.88 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.24 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.94 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.63 110.805 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.48 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.57 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.35 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.77 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 4.15 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.58 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.64 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . 0.451 ' O ' HG22 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.82 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . 0.511 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.49 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.575 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 3.25 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.44 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.73 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . 0.516 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.74 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 3.02 112.627 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.14 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 3.32 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.88 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.59 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . 0.465 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.92 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.51 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 3.37 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.26 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.71 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 4.02 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.32 110.007 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 6.01 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.12 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.7 110.492 -179.627 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 4.11 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.96 110.509 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.94 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.69 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.92 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.73 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.99 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.87 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.65 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.534 HG13 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.19 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.59 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.06 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.438 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 5.29 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.46 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.534 ' H ' HG13 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.93 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.519 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 3.11 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.445 HG23 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.93 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . 0.41 HG22 HD13 ' D' ' 18' ' ' ILE . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.31 109.778 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.77 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 5.14 111.523 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . 0.457 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.98 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.75 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 3.33 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.55 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 4.2 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 3.28 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 3.04 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.35 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.81 110.369 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.4 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' D' ' 29' ' ' ALA . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 4.0 109.151 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.66 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.51 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.53 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.34 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.73 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.24 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.19 110.777 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.486 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 2.0 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.76 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.75 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.486 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.68 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . 0.465 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 2.45 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.35 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 3.29 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.63 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 3.5 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.478 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.39 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.45 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.95 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.7 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.43 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 6.55 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 5.0 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.62 110.11 -179.723 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.69 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 5.18 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.64 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.86 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 3.36 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.588 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 3.49 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.711 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.44 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.79 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.528 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.91 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.4 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 4.19 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.458 HG22 ' CG2' ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.75 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.95 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.73 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.93 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 4.13 109.848 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.31 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 4.1 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 3.29 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 4.15 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.55 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.96 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.81 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.53 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 5.43 111.279 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.414 ' O ' HG23 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.43 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.49 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 3.39 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 3.37 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.476 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.51 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.87 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.41 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.43 110.651 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.68 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.28 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.57 110.495 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 3.37 110.137 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.6 110.568 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.51 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.58 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.79 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.58 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.69 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 5.07 109.798 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.51 112.784 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 7.13 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.78 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 6.49 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.57 110.939 -179.898 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.11 111.211 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.85 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 4.04 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.88 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.62 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . 0.427 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 4.11 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . 0.427 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.52 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.505 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.89 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 4.23 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.75 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.427 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 4.22 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.5 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.461 HG11 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 3.46 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.487 ' HB ' ' HD2' ' B' ' 19' ' ' PRO . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.95 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . 0.487 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.61 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.81 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.74 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 4.02 110.483 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 4.46 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 5.09 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.85 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 5.35 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 4.09 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.49 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.89 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.588 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.56 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.96 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 2.71 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.95 110.456 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.12 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.79 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.65 109.404 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.8 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.74 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.38 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 4.18 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.86 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.82 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 3.18 111.014 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.95 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.67 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 4.11 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.3 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.48 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 4.18 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.44 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.43 110.254 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.345 0.593 . . . . 5.01 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.42 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.54 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 4.61 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.98 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 4.0 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 3.28 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . 0.488 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 3.27 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . 0.655 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.57 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.77 110.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.24 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.619 ' NE ' HG21 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.35 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 3.02 110.906 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.81 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.72 109.329 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.71 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.88 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.24 110.648 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.94 110.229 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' C' ' 23' ' ' ARG . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.63 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.48 108.982 177.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.57 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.35 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.77 111.829 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 4.15 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . 0.435 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.58 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.64 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.82 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.49 109.712 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 3.25 111.192 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.44 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.73 110.779 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.74 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 3.02 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.14 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 3.32 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.88 109.863 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.59 110.794 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.92 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.51 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 3.37 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.26 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.71 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 4.02 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.32 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 6.01 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.12 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.7 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 4.11 110.503 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.96 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.94 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.69 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.92 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.73 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.99 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.87 109.101 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.65 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.435 HG11 ' O ' ' C' ' 30' ' ' GLU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.19 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.59 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.06 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 5.29 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.46 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.93 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 3.11 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.619 HG21 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.93 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.31 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.77 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 5.14 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.98 109.904 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.75 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 3.33 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.55 110.019 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 4.2 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 3.28 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 3.04 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.35 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.81 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.4 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 4.0 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . 0.49 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.66 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.51 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.53 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . 0.422 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.34 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.73 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . 0.455 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.24 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.19 111.042 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 2.0 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.76 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.75 110.919 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.68 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . 0.481 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 2.45 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . 0.455 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.35 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 3.29 110.181 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.63 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . 0.445 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 3.5 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.445 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.39 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.45 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . 0.41 ' HB2' ' H ' ' D' ' 51' ' ' ASN . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.95 111.946 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . 0.41 ' H ' ' HB2' ' D' ' 50' ' ' PRO . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.7 110.187 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 52' ' ' MET . . . . . 0.421 ' HE1' ' NE2' ' D' ' 55' ' ' GLN . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.43 110.25 -178.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 6.55 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 5.0 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . 0.421 ' NE2' ' HE1' ' D' ' 52' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.62 110.152 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.783 0 N-CA-C 112.291 -0.324 . . . . 3.69 112.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 5.18 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.64 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.86 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 3.36 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 3.49 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.44 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.79 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.444 ' H ' ' C ' ' A' ' 11' ' ' ASP . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.91 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.4 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 4.19 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.75 110.776 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.95 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.73 111.077 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.93 112.608 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 4.13 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.31 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.599 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 4.1 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 3.29 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 4.15 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.55 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.96 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.81 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.53 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 5.43 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.43 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.49 111.341 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 3.39 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 3.37 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 46' ' ' LYS . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.51 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.87 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.41 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.43 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.68 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.28 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.57 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 3.37 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.6 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.51 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.58 110.264 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.79 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.459 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.58 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.69 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 5.07 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.51 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 7.13 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.78 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 6.49 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.57 110.168 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 111.99 -0.444 . . . . 4.11 111.99 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.85 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 4.04 110.153 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.88 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.62 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 4.11 112.093 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.52 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.89 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 4.23 110.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.75 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 4.22 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.546 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.5 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.473 HG13 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 3.46 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.473 ' H ' HG13 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.95 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.61 113.97 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.81 111.535 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.74 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' B' ' 26' ' ' LEU . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 4.02 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 4.46 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 5.09 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.85 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 5.35 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 4.09 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.49 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.89 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.56 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.96 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 2.71 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.95 110.335 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.12 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.79 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.65 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.8 109.678 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.74 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.38 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 4.18 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.86 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.82 111.688 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 3.18 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.95 110.962 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.67 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 4.11 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.3 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.456 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.48 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . 0.456 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 4.18 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.44 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.43 111.219 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.682 0.277 . . . . 5.01 111.563 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.42 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.54 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 4.61 110.11 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.98 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 4.0 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 3.28 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . 0.405 HG23 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 3.27 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.57 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.77 109.973 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . 0.422 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.24 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.655 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.35 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . 0.456 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 3.02 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.81 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . 0.416 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.72 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . 0.416 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.71 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.88 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.24 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.94 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.428 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.63 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.48 109.638 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.57 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.35 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . 0.454 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.77 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 4.15 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.58 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . 0.563 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.64 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . 0.454 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.82 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.49 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 3.25 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.44 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.73 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.74 109.017 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 3.02 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.14 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 3.32 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.88 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.59 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.92 109.861 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.51 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 3.37 109.352 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.26 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.71 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 4.02 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.32 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 6.01 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.12 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.7 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 4.11 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.96 109.776 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.94 111.957 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.69 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.92 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.73 110.102 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.99 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.87 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . 0.449 ' HZ2' ' CG ' ' D' ' 11' ' ' ASP . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.65 112.009 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.19 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.563 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.59 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.06 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 5.29 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.46 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.51 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.93 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.655 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 3.11 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.93 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.31 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.77 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 5.14 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.98 111.225 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.75 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.422 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 3.33 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.55 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 4.2 110.466 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 3.28 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 3.04 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.35 110.436 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.81 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.4 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 4.0 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.66 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.51 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.53 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.34 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.73 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . 0.431 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.24 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.19 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 2.0 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.76 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.75 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.68 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 2.45 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.35 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 3.29 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.63 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 3.5 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.415 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.39 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.45 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.95 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.7 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.43 110.462 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 6.55 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 5.0 111.373 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.62 111.873 178.394 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.533 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.614 -0.595 . . . . 3.69 111.614 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 5' ' ' GLY . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 5.18 109.696 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.443 ' CG1' ' HB3' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.64 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.86 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 3.36 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 3.49 110.452 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.44 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.79 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.91 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.4 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 4.19 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.75 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.404 ' HA ' ' HA ' ' B' ' 15' ' ' ARG . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.95 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.73 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.436 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.93 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 4.13 111.212 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.31 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 4.1 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 3.29 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 4.15 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.55 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.96 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.81 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.53 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 5.43 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.406 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.43 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.49 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 3.39 110.352 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 3.37 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.51 110.634 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.477 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.87 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.501 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.41 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.43 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.68 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.28 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.57 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 3.37 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.6 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.51 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.58 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.79 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' NZ ' ' HA ' ' B' ' 41' ' ' GLU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.58 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.69 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 5.07 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.51 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 7.13 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.78 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 6.49 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.57 111.368 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . 0.501 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.41 -0.106 . . . . 4.11 112.837 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.85 111.096 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 4.04 110.233 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.415 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.88 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.415 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.62 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 4.11 110.062 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.52 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.89 110.166 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 4.23 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.75 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 4.22 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.5 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 3.46 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.95 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.61 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.81 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.74 109.685 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 4.02 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 4.46 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 5.09 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.85 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 5.35 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 4.09 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.49 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.89 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.56 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.96 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.443 ' HB3' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 2.71 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.95 109.487 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.405 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.12 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.79 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.65 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.533 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.8 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.74 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.38 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . 0.423 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 4.18 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.86 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.483 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.82 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 3.18 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.95 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . 0.405 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.67 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 4.11 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.3 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.48 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 4.18 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.44 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.43 110.621 179.749 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 3' ' ' SER . . . . . 0.405 ' OG ' HD12 ' C' ' 22' ' ' LEU . 19.3 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.318 0.58 . . . . 5.01 110.883 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.42 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.54 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . 0.406 HD11 HG21 ' C' ' 6' ' ' ILE . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 4.61 110.748 -178.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.98 110.486 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 4.0 110.468 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 3.28 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 3.27 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.57 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.77 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.24 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' D' ' 17' ' ' VAL . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.35 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . 0.469 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 3.02 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.4 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.81 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.72 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.71 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.88 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.24 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . 0.405 HD12 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.94 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.449 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.63 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.48 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.57 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.35 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.77 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 4.15 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.58 110.267 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.64 109.875 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.82 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.49 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 3.25 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.44 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.73 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . 0.568 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.74 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 3.02 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.14 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 3.32 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.88 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.59 110.845 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.92 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.51 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 3.37 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.26 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.71 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 4.02 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.32 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 6.01 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.12 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.7 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 4.11 110.236 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.96 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.568 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.94 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.69 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . 0.489 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.92 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.73 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.99 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.674 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.87 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.65 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.19 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.469 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.59 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.06 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.437 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 5.29 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . 0.449 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.46 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.437 ' CZ ' ' HB2' ' D' ' 13' ' ' LEU . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.93 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.469 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 3.11 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.674 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.93 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.31 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.77 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 5.14 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.98 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.75 110.228 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 3.33 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.55 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 4.2 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 3.28 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 3.04 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.35 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.81 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.4 111.121 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 4.0 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.66 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . 0.573 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.51 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.53 109.739 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.34 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . 0.432 HD12 HG21 ' D' ' 36' ' ' ILE . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.73 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . 0.467 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.24 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.19 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 2.0 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.76 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.75 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.68 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 2.45 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . 0.467 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.35 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 3.29 110.836 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.63 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 3.5 110.498 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.39 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.45 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.95 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.7 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.43 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 6.55 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 5.0 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.62 110.512 179.942 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.511 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 112.473 -0.251 . . . . 3.69 112.473 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 5.18 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.64 109.905 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.86 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 3.36 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 3.49 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.442 ' C ' ' H ' ' A' ' 13' ' ' LEU . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.44 110.527 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.79 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.442 ' H ' ' C ' ' A' ' 11' ' ' ASP . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.91 110.785 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.429 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.4 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.456 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 4.19 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.528 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.75 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.95 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.73 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.93 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 4.13 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.31 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 4.1 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.517 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 3.29 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 4.15 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.55 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.96 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.81 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.53 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 5.43 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.43 111.32 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.49 110.965 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 3.39 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 3.37 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 46' ' ' LYS . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.51 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.87 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.41 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.43 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.68 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.28 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.57 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 3.37 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.6 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.51 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.58 111.058 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.79 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.58 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.69 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 5.07 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.51 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 7.13 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.78 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 6.49 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.57 110.102 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.11 111.272 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.85 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 4.04 109.699 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.88 110.952 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.62 110.673 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 4.11 111.361 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.52 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.89 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 4.23 109.92 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.75 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 4.22 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.528 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.5 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.456 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 3.46 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.95 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.61 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.81 111.722 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.74 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 4.02 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 4.46 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 5.09 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.85 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 5.35 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . 0.429 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 4.09 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . 0.476 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.49 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.89 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.56 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.96 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.476 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 2.71 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.95 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.12 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.511 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.79 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.65 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.8 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.74 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.38 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 4.18 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.86 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.82 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 3.18 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.533 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.95 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.67 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 4.11 111.156 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.3 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.48 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 4.18 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.44 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 85.5 mmm . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.43 110.384 179.758 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.617 0.246 . . . . 5.01 111.606 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 4' ' ' THR . . . . . 0.431 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.42 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.54 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 4.61 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.98 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 4.0 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 3.28 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 3.27 108.696 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.57 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.77 109.909 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.24 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.407 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.35 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 3.02 109.858 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.81 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.72 109.792 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.71 110.919 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.88 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.24 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.94 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.63 109.851 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' C' ' 24' ' ' ARG . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.48 110.583 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.57 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.35 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . 0.418 HD11 HG22 ' C' ' 28' ' ' ILE . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.77 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 4.15 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.58 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.64 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . 0.475 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.82 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.49 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 3.25 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.44 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.73 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.74 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 3.02 111.767 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.14 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 3.32 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.88 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.59 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.92 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.51 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 3.37 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.26 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.71 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 4.02 109.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.32 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 6.01 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.12 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.7 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 4.11 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.96 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.94 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.69 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.92 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.73 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.99 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.551 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.87 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . 0.551 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.65 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.51 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.19 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.59 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.43 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.06 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 5.29 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . 0.51 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.46 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.93 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 3.11 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.93 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.31 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.77 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . 0.408 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 5.14 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.98 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.75 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 3.33 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.55 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 4.2 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 3.28 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 3.04 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . 0.41 HG21 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.35 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.81 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.4 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 4.0 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.66 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.51 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.53 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.34 108.302 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.73 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.24 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.19 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 2.0 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.76 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.75 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.68 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 2.45 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.35 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 3.29 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.63 111.167 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 3.5 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.41 ' CE1' HG21 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.39 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.45 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.95 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.7 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.43 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 6.55 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 5.0 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.62 111.145 179.78 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 111.396 -0.681 . . . . 3.69 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 5.18 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.4 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.64 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.86 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 3.36 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 3.49 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.53 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.44 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.79 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.53 ' HB2' ' OD2' ' A' ' 11' ' ' ASP . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.91 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.479 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.4 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HG2' ' CG ' ' A' ' 11' ' ' ASP . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 4.19 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.75 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.95 110.182 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.73 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.93 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.405 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 4.13 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.31 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 4.1 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 3.29 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 4.15 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.55 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.96 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.81 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.53 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 5.43 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.43 110.932 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.49 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 3.39 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 3.37 111.251 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.405 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.51 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.87 110.322 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.41 111.155 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.43 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.68 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.28 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.57 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.437 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 3.37 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.444 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.6 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.437 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.51 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.58 109.253 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.79 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.58 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.69 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 5.07 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.51 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 7.13 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.78 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 6.49 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.57 109.997 179.224 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.795 0 N-CA-C 112.122 -0.391 . . . . 4.11 112.122 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.85 110.204 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 4.04 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.88 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.62 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 4.11 110.093 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.52 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.89 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 4.23 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . 0.469 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.75 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 4.22 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.5 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 3.46 111.618 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.95 110.048 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.61 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . 0.427 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.81 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.74 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 4.02 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.479 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 4.46 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.427 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 5.09 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.85 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 5.35 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 4.09 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.49 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.89 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.56 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.96 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 2.71 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.95 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.12 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.436 HD11 HG21 ' B' ' 36' ' ' ILE . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.79 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.65 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.8 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.74 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.38 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 4.18 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.86 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.82 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 3.18 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.508 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.95 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . 0.5 ' HZ2' ' CD ' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.67 110.866 -179.488 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 4.11 110.356 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.3 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.48 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 4.18 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.44 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.43 110.881 -179.179 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 120.661 0.267 . . . . 5.01 110.921 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.42 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.54 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 4.61 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.98 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 4.0 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 3.28 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 3.27 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.57 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . 0.533 HD23 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.77 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.24 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.35 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 3.02 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.81 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.72 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.71 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.88 111.03 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.24 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.94 111.433 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.514 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.63 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' C' ' 24' ' ' ARG . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.48 111.418 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.57 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.35 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.77 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 4.15 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.58 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.64 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.82 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.49 110.554 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 3.25 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.44 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.73 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.74 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 3.02 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.14 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 3.32 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.88 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.59 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.92 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.51 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 3.37 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.26 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.71 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 4.02 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.32 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 6.01 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.12 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.7 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 4.11 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.96 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.409 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.94 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.69 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.92 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.73 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.99 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.87 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.65 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.19 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.54 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.59 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.06 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.54 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 5.29 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . 0.514 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.46 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.533 HH11 HD23 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.93 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 3.11 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.49 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.93 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.31 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.77 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 5.14 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.98 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . 0.409 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.75 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 3.33 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.55 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 4.2 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 3.28 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 3.04 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . 0.487 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.35 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . 0.469 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.81 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.4 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 4.0 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.66 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.51 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.53 110.261 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.34 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.73 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.24 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.19 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.614 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 2.0 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.76 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.75 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.68 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 2.45 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.35 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . 0.443 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 3.29 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.63 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 3.5 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.39 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.45 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.95 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.7 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.43 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 6.55 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 5.0 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.62 110.041 -179.055 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 N-CA-C 112.362 -0.295 . . . . 3.69 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 5.18 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.64 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.86 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 3.36 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.417 HG21 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 3.49 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.44 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.79 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.91 111.499 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.4 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.449 ' CZ ' ' HB2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 4.19 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.426 HG11 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.75 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.95 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.73 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.93 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 4.13 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.31 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 4.1 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 3.29 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 4.15 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.55 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.96 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.81 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.53 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 5.43 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.43 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.49 110.208 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 3.39 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 3.37 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.51 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.87 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.41 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.43 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.68 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.28 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.497 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.57 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.497 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 3.37 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.6 108.807 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.51 111.33 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.58 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.79 109.872 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.58 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.571 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.69 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 5.07 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.51 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 7.13 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.78 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.547 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 6.49 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.57 109.845 179.607 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.502 0 N-CA-C 111.272 -0.731 . . . . 4.11 111.272 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.85 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 4.04 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.88 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.62 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 4.11 109.542 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.52 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.89 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 4.23 109.802 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.75 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 4.22 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.426 ' HB ' HG11 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.5 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 3.46 111.531 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.95 109.172 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.61 113.109 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.81 112.625 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.74 111.872 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 4.02 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 4.46 111.146 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 5.09 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.85 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 5.35 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 4.09 111.268 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.49 111.406 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.89 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.56 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.96 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.417 ' O ' HG21 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 2.71 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.95 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.12 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.79 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.65 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.8 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.74 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.38 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 4.18 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.86 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.82 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 3.18 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.95 109.787 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.67 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 4.11 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.3 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.48 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 4.18 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.44 111.422 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.43 110.289 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.414 0.626 . . . . 5.01 110.038 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.42 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.54 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 4.61 110.054 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.98 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 4.0 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 3.28 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 3.27 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.57 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.77 110.95 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.24 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.35 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 3.02 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.81 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.72 109.602 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.71 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.88 111.421 -179.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.24 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.94 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.63 110.818 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.48 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.57 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.35 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.77 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 4.15 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.58 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . 0.498 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.64 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.82 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.49 110.899 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 3.25 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.685 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.44 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.73 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.74 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 3.02 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.14 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 3.32 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.88 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.59 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . 0.685 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.92 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.51 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 3.37 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.26 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.71 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 4.02 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.32 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 6.01 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.12 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.7 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 1' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 4.11 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.96 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.94 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.69 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.92 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.73 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.99 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.437 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.87 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.65 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.408 ' HB ' ' H ' ' D' ' 11' ' ' ASP . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.19 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.529 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.59 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.498 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.06 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.404 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 5.29 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.46 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.529 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.93 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 3.11 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.93 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.31 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.77 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 5.14 110.522 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.98 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.75 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 3.33 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.55 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 4.2 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 3.28 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 3.04 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.35 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.81 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.424 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.4 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 4.0 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.66 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.51 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.53 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.34 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.73 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.24 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.19 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 2.0 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.76 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.75 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.68 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 2.45 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.35 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 3.29 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.408 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.63 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 3.5 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.39 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.45 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.95 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.7 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.43 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 6.55 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 5.0 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.62 109.564 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.69 110.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 5.18 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.64 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.86 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 3.36 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 3.49 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.448 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.44 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.79 109.993 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.91 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.4 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.448 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 4.19 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.482 HG23 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.75 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.482 ' H ' HG23 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.95 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.73 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.597 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.93 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 4.13 111.277 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.31 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 4.1 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.597 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 3.29 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 4.15 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.433 HG22 ' H1 ' ' D' ' 1' ' ' MET . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.55 111.141 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.96 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.81 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.53 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 5.43 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.43 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.49 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 3.39 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 3.37 110.671 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.51 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.426 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.87 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.41 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.43 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.68 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.28 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.57 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 3.37 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.6 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.429 HD12 HG23 ' A' ' 44' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.51 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.58 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.79 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.58 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.69 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 5.07 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.562 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.51 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 7.13 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.78 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 6.49 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t . . . . . 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.57 111.216 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 111.345 -0.702 . . . . 4.11 111.345 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . 0.426 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.85 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 4.04 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.88 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.62 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 4.11 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.52 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.89 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.408 HD23 ' N ' ' B' ' 13' ' ' LEU . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 4.23 110.363 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.75 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 4.22 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.5 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 3.46 111.201 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.95 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.61 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.81 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.74 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 4.02 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 4.46 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 5.09 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.85 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 5.35 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 4.09 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.49 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.89 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.56 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.96 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 2.71 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.95 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 49' ' ' LYS . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.12 110.332 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.79 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.65 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.8 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.74 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.38 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 4.18 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.86 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.82 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.461 HD12 HG23 ' B' ' 44' ' ' ILE . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 3.18 110.659 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.95 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.67 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 4.11 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.3 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' B' ' 35' ' ' GLU . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.48 110.438 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 4.18 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.44 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.43 110.443 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 120.764 0.316 . . . . 5.01 110.15 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.42 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.54 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 4.61 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.98 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 4.0 110.104 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 3.28 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . 0.518 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 3.27 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.57 109.178 178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.77 111.652 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.24 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.35 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 3.02 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.402 HG21 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.81 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.72 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . 0.531 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.71 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . 0.43 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.88 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.24 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.94 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.63 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . 0.43 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.48 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 25' ' ' THR . . . . . 0.414 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.57 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.35 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.77 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 4.15 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.58 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.64 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.82 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.49 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 3.25 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.477 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.44 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.73 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.74 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' D' ' 3' ' ' SER . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 3.02 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.14 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 3.32 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.88 109.801 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.59 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.92 109.768 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.51 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 3.37 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.26 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . 0.464 ' HZ1' ' CD ' ' C' ' 35' ' ' GLU . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.71 109.588 -179.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 4.02 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.32 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 6.01 110.034 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.12 111.437 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.7 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 1' ' ' MET . . . . . 0.433 ' H1 ' HG22 ' A' ' 25' ' ' THR . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 4.11 110.253 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.96 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.497 ' O ' HG23 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.94 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.69 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.92 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.73 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.99 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.87 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.65 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.405 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.19 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.564 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.59 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.564 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.06 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 5.29 111.386 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.46 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.419 ' O ' ' HB2' ' D' ' 11' ' ' ASP . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.93 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 3.11 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.93 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.31 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.77 113.745 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 5.14 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.98 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.75 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 3.33 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.55 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 4.2 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 3.28 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 3.04 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.35 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.81 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.4 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 4.0 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.66 110.509 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.51 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.53 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . 0.412 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.34 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.73 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.24 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.19 110.637 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.625 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 2.0 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.76 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.75 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.68 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 2.45 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.35 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 3.29 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.63 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 3.5 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.39 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.45 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.95 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.7 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 52' ' ' MET . . . . . 0.422 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.43 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 53' ' ' THR . . . . . 0.402 ' H ' ' C ' ' D' ' 51' ' ' ASN . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 6.55 110.619 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 5.0 110.626 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.62 109.913 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 CA-C-O 120.809 0.116 . . . . 3.69 113.267 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 5.18 110.679 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.64 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.86 109.936 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 3.36 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.487 ' CG2' ' HA ' ' B' ' 31' ' ' LYS . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 3.49 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.44 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.79 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.91 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.4 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 4.19 110.383 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.75 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.95 110.927 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.73 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.93 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.48 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 4.13 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.31 110.452 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 4.1 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 3.29 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 4.15 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.55 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.96 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.81 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.53 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 5.43 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' A' ' 31' ' ' LYS . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.43 110.614 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 30' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.49 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 3.39 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 3.37 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.51 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.87 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.41 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.43 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.68 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.28 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.57 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 3.37 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.6 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.51 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.58 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.79 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.58 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.69 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 5.07 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.51 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 7.13 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.78 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 6.49 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m . . . . . 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.57 110.12 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.11 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.85 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 4.04 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.88 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.62 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 4.11 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . 0.467 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.52 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.48 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.89 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 4.23 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.75 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 4.22 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.5 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 3.46 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.95 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.61 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.81 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.74 111.227 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 4.02 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 4.46 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 5.09 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.85 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 5.35 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 4.09 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.49 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.89 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.56 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.487 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.96 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.437 ' H ' HG21 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 2.71 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.95 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.12 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.79 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.65 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 42' ' ' LYS . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.8 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.74 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.38 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 4.18 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.86 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.82 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 3.18 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.411 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.95 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . 0.403 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.67 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 4.11 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.3 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.48 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 4.18 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.44 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.43 109.812 179.322 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.591 -0.151 . . . . 5.01 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.42 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.54 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 4.61 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.98 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 4.0 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 3.28 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 3.27 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . 0.684 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.57 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.77 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . 0.576 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.24 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.684 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.35 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . 0.511 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 3.02 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.81 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.72 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.71 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.88 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.24 109.537 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.94 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.63 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.48 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.57 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.35 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.77 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 4.15 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . 0.465 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.58 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.64 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.82 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.49 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 3.25 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.44 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.73 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.74 108.763 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 3.02 111.883 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . 0.486 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.14 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 3.32 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.88 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.59 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.92 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . 0.467 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.51 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 3.37 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.26 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.71 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 4.02 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.32 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 6.01 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.12 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.7 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 4.11 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . 0.495 ' H ' HD13 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.96 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.94 111.87 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.69 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.92 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . 0.495 HD13 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.73 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.99 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.87 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . 0.4 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.65 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.496 ' CG1' ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.19 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . 0.496 ' H ' ' CG1' ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.59 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.06 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . 0.403 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 5.29 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.46 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.403 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.93 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.511 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 3.11 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.93 110.788 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . 0.445 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.31 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . 0.423 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.77 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 5.14 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.98 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.75 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.576 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 3.33 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.55 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 4.2 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 3.28 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 3.04 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.35 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.81 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.497 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.4 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 4.0 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.66 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.51 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.53 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.34 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.73 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.24 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.19 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 2.0 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.76 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.75 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.68 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 2.45 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.35 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 3.29 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . 0.411 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.63 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 3.5 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.39 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.45 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.95 111.258 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.7 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.43 110.33 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 6.55 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 5.0 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.62 110.153 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 N-CA-C 111.978 -0.449 . . . . 3.69 111.978 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 5.18 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.64 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.86 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 3.36 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 3.49 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.402 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.44 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.79 110.941 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.91 110.68 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.4 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 4.19 112.014 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.507 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.75 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.95 112.172 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.73 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.93 112.421 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 4.13 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.31 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.424 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 4.1 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 3.29 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 4.15 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.55 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.96 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.81 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.53 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 5.43 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.43 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.49 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 3.39 111.174 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 3.37 109.846 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.51 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.87 110.629 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.41 109.347 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.43 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.68 109.314 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.28 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.57 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 3.37 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.6 109.84 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.51 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.58 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.79 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.861 ' HZ2' ' HH ' ' A' ' 48' ' ' TYR . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.58 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.861 ' HH ' ' HZ2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.69 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.422 ' H ' ' HB2' ' A' ' 48' ' ' TYR . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 5.07 110.228 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.51 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 7.13 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.78 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 6.49 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.57 110.222 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 112.297 -0.321 . . . . 4.11 112.297 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.85 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 4.04 110.868 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.88 109.662 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.62 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 4.11 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.52 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.89 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 4.23 109.846 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.75 114.105 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.513 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 4.22 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.507 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.5 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 3.46 110.841 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.401 ' CG2' ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.95 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . 0.401 ' HD2' ' CG2' ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.61 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.81 111.34 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.74 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' LEU . . . . . 0.402 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 4.02 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 4.46 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.53 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 5.09 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.85 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.435 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 5.35 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 4.09 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.49 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.89 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.56 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.96 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 2.71 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.95 110.042 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.12 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.79 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.65 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.8 110.813 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.74 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.38 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 4.18 110.554 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.439 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.86 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.82 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 3.18 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.95 108.33 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.67 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 4.11 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' TYR . . . . . 0.423 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.3 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.48 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 4.18 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.44 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.43 110.454 -179.593 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.579 0.585 . . . . 5.01 112.579 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.42 109.763 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.54 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 4.61 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.98 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 4.0 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 3.28 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 3.27 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 11' ' ' ASP . . . . . 0.422 ' HB3' ' H ' ' C' ' 12' ' ' GLU . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.57 108.671 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 12' ' ' GLU . . . . . 0.542 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 13' ' ' LEU . . . . . 0.405 ' HA ' ' HG3' ' D' ' 23' ' ' ARG . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.77 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 14' ' ' GLY . . . . . 0.411 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.24 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . 0.511 ' CZ ' ' HB3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.35 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 16' ' ' VAL . . . . . 0.526 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 3.02 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 17' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.81 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.72 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.71 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.88 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.24 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 22' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.94 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 23' ' ' ARG . . . . . 0.495 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.63 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.48 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.57 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.35 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.77 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 4.15 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 30' ' ' GLU . . . . . 0.495 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.58 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 31' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.64 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.82 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 33' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.49 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 3.25 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 35' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.44 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.73 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.74 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 38' ' ' VAL . . . . . 0.422 HG12 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 3.02 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 39' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 40' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.14 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 3.32 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.88 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.59 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.92 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.51 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 3.37 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 48' ' ' TYR . . . . . 0.541 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.26 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.71 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 4.02 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.32 110.189 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 53' ' ' THR . . . . . 0.417 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 6.01 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 54' ' ' CYS . . . . . 0.417 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.12 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.7 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 1' ' ' MET . . . . . 0.421 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 4.11 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.96 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 3' ' ' SER . . . . . 0.422 ' CB ' HG12 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.94 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.69 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.92 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.73 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 7' ' ' VAL . . . . . 0.536 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.99 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 8' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.87 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 9' ' ' LYS . . . . . 0.447 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.65 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 10' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.19 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.59 109.93 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 12' ' ' GLU . . . . . 0.407 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.06 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 5.29 109.6 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.46 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' C' ' 15' ' ' ARG . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.93 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 16' ' ' VAL . . . . . 0.526 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 3.11 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 17' ' ' VAL . . . . . 0.434 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.93 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 18' ' ' ILE . . . . . 0.411 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.31 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 19' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.77 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 20' ' ' ILE . . . . . 0.478 ' O ' ' HG3' ' D' ' 24' ' ' ARG . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 5.14 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.98 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 22' ' ' LEU . . . . . 0.439 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.75 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 23' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' C' ' 13' ' ' LEU . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 3.33 111.682 -179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 24' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.55 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 4.2 110.296 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 3.28 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 3.04 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.35 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.81 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 30' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.4 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 4.0 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.66 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.51 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.53 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.34 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.73 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.24 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.19 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 39' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 2.0 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.76 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.75 111.382 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 42' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.68 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 2.45 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.35 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 45' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' C' ' 43' ' ' ILE . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 3.29 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.63 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 3.5 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.39 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 49' ' ' LYS . . . . . 0.435 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.45 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 50' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.95 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.7 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.43 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 6.55 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 5.0 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.62 110.197 -179.019 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 tpt . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.743 0.306 . . . . 9.79 110.336 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.7 mmtt -140.14 -171.49 3.2 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.124 -0.489 . . . . 10.89 109.971 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -73.02 88.2 1.39 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.979 0.418 . . . . 7.99 110.548 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -159.67 153.73 23.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.066 -0.515 . . . . 5.88 110.39 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.77 -151.25 5.39 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.957 -0.639 . . . . 3.69 111.901 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.417 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 5.18 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.64 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.86 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 3.36 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 3.49 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.44 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.79 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.91 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.4 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.441 HH22 ' H71' ' E' ' 6' ' ' ' DT' . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 4.19 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.75 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.521 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.95 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.73 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.93 113.449 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.415 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 4.13 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.31 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 4.1 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.526 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 3.29 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 4.15 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.55 111.035 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.96 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.81 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.53 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 5.43 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.43 111.671 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.49 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.526 ' O ' HG23 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 3.39 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 3.37 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.51 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.87 110.002 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.41 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.43 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.68 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.28 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.57 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 3.37 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.6 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.51 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.58 110.175 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.79 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.58 108.969 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.69 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 5.07 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.51 112.329 -179.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 7.13 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.78 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 6.49 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.13 -10.12 26.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.57 110.424 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 7.28 110.264 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.577 0.703 . . . . 10.76 109.547 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -92.47 -156.55 0.47 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.998 -1.001 . . . . 9.42 109.63 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m -86.18 64.88 8.81 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.049 -0.352 . . . . 6.91 110.049 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -33.63 56.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 5.83 111.503 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.12 124.54 1.31 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.85 -0.691 . . . . 4.11 111.463 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . 0.406 ' CG2' ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.85 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 4.04 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.472 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.88 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.62 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 4.11 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.52 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.89 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 4.23 110.376 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . 0.526 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.75 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 4.22 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.5 108.096 177.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 3.46 112.247 -178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.95 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.61 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.472 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.81 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.74 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 4.02 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 4.46 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 5.09 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.85 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 5.35 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 4.09 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.49 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.89 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.56 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.96 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 2.71 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.95 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.12 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.417 ' HB ' ' HB ' ' A' ' 6' ' ' ILE . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.79 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.46 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.65 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.8 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.74 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.38 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 4.18 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.86 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.82 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.46 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 3.18 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.95 110.715 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.67 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 4.11 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.3 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.48 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 4.18 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.44 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.59 123.55 27.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.43 110.329 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.52 -36.1 13.92 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 5.68 111.472 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 18.4 t -155.34 161.09 41.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 5.52 110.041 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.411 -0.359 . . . . 6.38 110.488 179.511 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 82.0 mmm . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.298 0.571 . . . . 8.0 110.398 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -61.13 123.99 19.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.438 -0.801 . . . . 9.03 111.246 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 1.8 m -127.14 26.52 6.05 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.399 -0.819 . . . . 5.01 109.069 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.42 110.354 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.54 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 4.61 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.98 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 4.0 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 3.28 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 3.27 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.57 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . 0.506 ' HG ' ' H41' ' F' ' 9' ' ' ' DC' . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.77 111.037 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.24 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' D' ' 16' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.35 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . 0.412 ' HB ' ' H ' ' C' ' 17' ' ' VAL . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 3.02 111.86 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.412 ' H ' ' HB ' ' C' ' 16' ' ' VAL . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.81 111.362 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.72 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.71 112.579 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.88 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.24 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.94 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.63 110.805 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.48 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.57 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.35 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.77 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 4.15 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.58 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.64 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . 0.451 ' O ' HG22 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.82 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . 0.511 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.49 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.575 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 3.25 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.44 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.73 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . 0.516 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.74 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 3.02 112.627 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.14 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 3.32 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.88 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.59 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . 0.465 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.92 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.51 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 3.37 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.26 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.71 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 4.02 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.32 110.007 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 6.01 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.12 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.7 110.492 -179.627 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 4.11 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.96 110.509 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.94 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.69 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.92 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.73 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.99 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.511 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.87 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.65 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.534 HG13 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.19 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.59 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.06 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.438 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 5.29 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.46 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.534 ' H ' HG13 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.93 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.519 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 3.11 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.445 HG23 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.93 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . 0.41 HG22 HD13 ' D' ' 18' ' ' ILE . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.31 109.778 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.77 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 5.14 111.523 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . 0.457 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.98 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.75 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 3.33 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.55 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 4.2 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 3.28 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 3.04 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.35 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.81 110.369 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.4 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' D' ' 29' ' ' ALA . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 4.0 109.151 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.66 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.51 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.53 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.34 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.73 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.24 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.19 110.777 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.486 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 2.0 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.76 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.75 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.486 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.68 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . 0.465 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 2.45 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.35 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 3.29 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.63 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 3.5 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.478 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.39 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.45 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.95 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.7 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.43 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 6.55 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 5.0 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.62 110.11 -179.723 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.667 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 O4'-C1'-C2' 106.963 0.784 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.667 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 N19-C1'-C2' 117.169 1.855 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.659 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O4'-C1'-N19 109.404 2.005 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.659 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.114 1.642 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.508 ' C7 ' H2'' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-N19 109.483 2.103 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.681 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O3'-P-O5' 100.26 -1.968 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.681 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 O4'-C1'-N19 109.609 2.262 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.532 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O3'-P-O5' 100.982 -1.588 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.532 ' C6 ' H2'' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 O3'-P-O5' 100.249 -1.974 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.601 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.243 -1.977 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.719 2.399 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.545 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.754 0 O4'-C1'-N19 109.545 2.181 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.545 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.878 0 O3'-P-O5' 99.567 -2.333 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.797 2.497 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.511 H2'' ' C7 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.811 0 O3'-P-O5' 99.489 -2.374 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.511 ' C7 ' H2'' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.957 2.696 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.472 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.775 0 O4'-C1'-N19 109.586 2.233 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.545 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 109.573 2.216 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.729 0 O4'-C1'-N19 109.458 2.073 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.492 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.808 0 O4'-C1'-N19 109.518 2.147 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.492 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.559 2.198 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.491 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 O4'-C1'-N19 109.708 2.385 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.417 H2'' ' C6 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.687 0 O3'-P-O5' 99.842 -2.188 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.463 H2'' ' C7 ' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O3'-P-O5' 100.709 -1.732 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.463 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 N19-C1'-C2' 116.196 1.247 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.731 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C4'-C3'-C2' 102.401 -0.799 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.731 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.845 0 N19-C1'-C2' 116.84 1.65 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.574 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.498 3.372 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-N19 109.703 2.378 . . . . 4.55 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 99.766 -2.228 . . . . 4.21 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.478 H2'' ' C7 ' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.785 0 O3'-P-O5' 99.372 -2.436 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.51 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 O4'-C1'-N19 109.647 2.309 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.51 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O3'-P-O5' 99.916 -2.149 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.506 ' H41' ' HG ' ' C' ' 13' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.599 2.249 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.503 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 109.366 1.957 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.419 -0.934 0 O4'-C1'-N19 109.671 2.339 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.472 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.112 0 O3'-P-O5' 99.21 -2.521 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.705 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.423 -0.652 0 O3'-P-O5' 99.722 -2.251 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.705 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -1.024 0 O4'-C1'-N19 109.892 2.615 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.511 H2'' ' C7 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.838 0 O3'-P-O5' 99.607 -2.312 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.511 ' C7 ' H2'' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 O4'-C1'-N19 109.49 2.112 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.497 H2'' ' C7 ' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O3'-P-O5' 99.495 -2.371 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.497 ' C7 ' H2'' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O3'-P-O5' 99.3 -2.474 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.764 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.803 0 N19-C1'-C2' 118.104 2.44 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.764 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O4'-C1'-N19 109.577 2.221 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.579 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C1'-N19 109.42 2.025 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.568 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.598 0 O3'-P-O5' 100.047 -2.08 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.682 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 O3'-P-O5' 100.461 -1.863 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.682 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O3'-P-O5' 101.31 -1.416 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.45 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.53 0.664 0 N19-C1'-C2' 116.207 1.254 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.502 ' H1 ' ' N ' ' D' ' 1' ' ' MET . 47.2 ttm . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 121.059 0.457 . . . . 9.79 110.558 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.57 136.28 2.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.863 -0.608 . . . . 10.89 109.703 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.0 m -141.45 168.97 18.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.216 -0.447 . . . . 7.99 110.068 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 m -92.42 -53.72 4.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.214 0.53 . . . . 5.88 110.047 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -107.13 102.47 1.84 Allowed Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.69 110.987 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 5.18 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.64 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.86 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 3.36 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.588 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 3.49 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.711 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.44 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.79 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.528 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.91 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.4 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 4.19 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.458 HG22 ' CG2' ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.75 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.95 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.73 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.93 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.421 HG12 H5'' ' F' ' 14' ' ' ' DA' . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 4.13 109.848 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.31 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 4.1 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 3.29 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 4.15 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.55 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.96 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.81 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.53 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 5.43 111.279 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.414 ' O ' HG23 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.43 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.49 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 3.39 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 3.37 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.476 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.51 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.87 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.41 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.43 110.651 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.68 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.28 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.57 110.495 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 3.37 110.137 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.6 110.568 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.51 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.58 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.79 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.58 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.69 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 5.07 109.798 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.51 112.784 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 7.13 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.78 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 6.49 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t 67.62 87.34 0.12 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.57 110.939 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.834 -0.621 . . . . 7.28 110.168 179.589 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.0 ttt . . . . . 0 C--O 1.236 0.342 0 CA-C-O 120.439 0.161 . . . . 10.76 110.581 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 84.5 mttt 60.18 86.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.715 0.634 . . . . 9.42 111.411 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -82.55 137.73 34.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.138 -0.483 . . . . 6.91 110.605 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -82.14 -28.09 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.252 0.548 . . . . 5.83 110.33 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.01 123.72 1.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.11 111.211 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.85 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 4.04 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.88 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.62 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . 0.427 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 4.11 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . 0.427 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.52 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.505 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.89 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 4.23 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.75 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.427 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 4.22 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.5 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.461 HG11 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 3.46 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.487 ' HB ' ' HD2' ' B' ' 19' ' ' PRO . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.95 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . 0.487 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.61 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.81 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.74 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 4.02 110.483 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 4.46 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 5.09 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.85 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 5.35 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 4.09 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.49 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.89 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.588 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.56 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.96 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 2.71 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.95 110.456 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.12 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.79 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.65 109.404 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.8 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.74 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.38 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 4.18 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.86 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.82 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 3.18 111.014 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.95 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.67 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 4.11 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.3 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.48 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 4.18 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.44 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 81.8 1.13 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.43 110.254 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.13 145.99 25.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.205 -0.452 . . . . 5.68 111.375 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -71.23 115.03 9.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.697 -0.683 . . . . 5.52 109.594 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.506 -0.315 . . . . 6.38 110.554 -179.872 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.723 0.297 . . . . 8.0 110.37 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -161.1 74.34 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.03 -0.532 . . . . 9.03 111.143 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -86.15 45.89 1.27 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.345 0.593 . . . . 5.01 110.177 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.42 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.54 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 4.61 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.98 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 4.0 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 3.28 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.488 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 3.27 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . 0.655 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.57 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.77 110.064 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.24 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.619 ' NE ' HG21 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.35 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 3.02 110.906 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.81 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.72 109.329 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.71 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.88 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.24 110.648 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.94 110.229 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.468 HH22 " C3'" ' F' ' 5' ' ' ' DT' . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.63 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.48 108.982 177.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.57 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.35 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.77 111.829 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 4.15 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . 0.435 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.58 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.64 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.82 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.49 109.712 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 3.25 111.192 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.44 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.73 110.779 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.74 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 3.02 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.14 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 3.32 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.88 109.863 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.59 110.794 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.92 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.51 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 3.37 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.26 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.71 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 4.02 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.32 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 6.01 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.12 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.7 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 1' ' ' MET . . . . . 0.502 ' N ' ' H1 ' ' A' ' 1' ' ' MET . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 4.11 110.503 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.96 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.94 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.69 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.92 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.73 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.99 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.87 109.101 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.65 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.435 HG11 ' O ' ' C' ' 30' ' ' GLU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.19 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.59 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.06 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 5.29 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.46 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.93 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 3.11 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.619 HG21 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.93 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.31 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.77 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 5.14 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.98 109.904 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.75 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 3.33 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.55 110.019 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 4.2 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 3.28 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 3.04 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.35 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.81 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.4 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 4.0 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . 0.49 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.66 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.51 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.53 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . 0.422 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.34 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.73 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . 0.455 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.24 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.19 111.042 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 2.0 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.76 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.75 110.919 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.68 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . 0.481 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 2.45 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . 0.455 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.35 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 3.29 110.181 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.63 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . 0.445 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 3.5 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.445 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.39 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.45 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . 0.41 ' HB2' ' H ' ' D' ' 51' ' ' ASN . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.95 111.946 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . 0.41 ' H ' ' HB2' ' D' ' 50' ' ' PRO . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.7 110.187 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 52' ' ' MET . . . . . 0.421 ' HE1' ' NE2' ' D' ' 55' ' ' GLN . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.43 110.25 -178.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 6.55 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 5.0 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . 0.421 ' NE2' ' HE1' ' D' ' 52' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.62 110.152 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.697 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.489 0 O4'-C1'-C2' 107.215 1.014 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.697 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 N19-C1'-C2' 117.255 1.91 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.734 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O3'-P-O5' 101.26 -1.442 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.734 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-N19 109.76 2.45 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.606 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.413 2.017 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.606 ' C6 ' H2'' ' E' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.19 1.738 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.677 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 109.283 1.854 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.677 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.756 0 O4'-C1'-N19 109.66 2.325 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.718 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O3'-P-O5' 100.369 -1.911 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.718 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-N19 109.421 2.027 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.435 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-N19 109.565 2.206 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.424 H2'' ' C7 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.898 2.622 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.593 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.621 0 O4'-C1'-N19 109.646 2.308 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.593 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-N19 109.437 2.046 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 O4'-C1'-N19 109.847 2.559 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.56 ' C6 ' H2'' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O3'-P-O5' 99.598 -2.317 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.45 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O4'-C1'-N19 109.735 2.419 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.601 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.714 0 O3'-P-O5' 99.513 -2.362 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-N19 109.425 2.032 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.589 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.673 0 O4'-C1'-N19 109.634 2.292 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.434 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.796 0 O4'-C1'-N19 109.361 1.951 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.445 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-N19 109.594 2.242 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.485 H2'' ' C7 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.465 0 O4'-C1'-N19 109.69 2.362 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.485 ' C7 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.607 0 O3'-P-O5' 100.382 -1.904 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.433 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.529 0.567 0 N19-C1'-C2' 115.931 1.082 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.701 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O5'-C5'-C4' 111.585 0.99 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.701 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.869 0 N19-C1'-C2' 116.786 1.616 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.515 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 O4'-C1'-N19 109.762 2.453 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.955 2.694 . . . . 4.55 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.512 " C2'" ' H73' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O3'-P-O5' 99.694 -2.266 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.512 ' H73' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-N19 109.557 2.197 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.533 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.837 0 O4'-C1'-N19 109.603 2.254 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.533 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.87 0 O3'-P-O5' 99.566 -2.334 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.526 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.86 0 O4'-C1'-N19 110.186 2.983 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.506 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O3'-P-O5' 99.499 -2.369 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.506 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.427 2.033 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.636 " H1'" ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.774 0 N19-C1'-C2' 118.103 2.439 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.636 ' C8 ' " H1'" ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C1'-N19 109.871 2.588 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.421 H5'' HG12 ' A' ' 20' ' ' ILE . . . . . . . . 0 P--O3' 1.599 -0.708 0 O3'-P-O5' 99.224 -2.514 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.41 H2'' ' C6 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 O4'-C1'-N19 109.819 2.524 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.703 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.772 0 O3'-P-O5' 99.788 -2.217 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.703 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C1'-N19 110.052 2.815 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.6 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.823 0 O3'-P-O5' 100.189 -2.006 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.6 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.795 0 O4'-C1'-N19 110.077 2.847 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.62 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.872 0 O3'-P-O5' 100.084 -2.061 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.62 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.072 0 O4'-C1'-N19 109.8 2.5 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.74 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.597 0 O3'-P-O5' 100.224 -1.987 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.74 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 N19-C1'-C2' 116.997 1.748 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.637 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.781 1.227 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.474 ' C7 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 N19-C1'-C2' 115.973 1.108 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.562 ' N ' ' HB3' ' D' ' 21' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 110.114 -0.328 . . . . 9.79 110.114 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.452 ' HE2' ' OG1' ' D' ' 25' ' ' THR . 0.0 OUTLIER -105.54 147.7 28.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 10.89 111.339 -179.533 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.413 ' CB ' ' HB ' ' B' ' 38' ' ' VAL . 0.0 OUTLIER -78.92 -2.65 40.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.606 -0.724 . . . . 7.99 111.72 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.49 -7.19 41.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.262 -0.426 . . . . 5.88 112.01 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 122.55 88.62 0.92 Allowed Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.697 -0.763 . . . . 3.69 112.291 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 5.18 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.64 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.86 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 3.36 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 3.49 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.44 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.79 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.444 ' H ' ' C ' ' A' ' 11' ' ' ASP . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.91 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.4 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 4.19 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.75 110.776 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.95 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.73 111.077 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.93 112.608 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 4.13 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.31 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.599 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 4.1 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 3.29 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 4.15 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.55 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.96 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.81 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.53 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 5.43 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.43 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.49 111.341 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 3.39 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 3.37 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 46' ' ' LYS . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.51 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.87 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.41 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.43 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.68 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.28 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.57 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 3.37 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.6 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.51 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.58 110.264 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.79 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.459 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.58 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.69 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 5.07 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.51 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 7.13 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.78 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 6.49 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.66 86.91 7.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.57 110.168 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.218 -0.446 . . . . 7.28 111.121 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 C--O 1.233 0.198 0 CA-C-O 121.076 0.465 . . . . 10.76 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.402 ' HA ' HD22 ' B' ' 22' ' ' LEU . 14.7 mptt -67.11 136.16 54.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.894 -0.594 . . . . 9.42 110.743 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.83 92.52 3.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.18 -0.464 . . . . 6.91 110.514 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.4 79.95 6.2 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.199 -0.455 . . . . 5.83 111.829 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.35 54.43 1.02 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.771 -0.728 . . . . 4.11 111.99 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.85 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 4.04 110.153 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.88 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.62 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 4.11 112.093 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.52 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.89 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 4.23 110.251 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.75 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 4.22 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.546 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.5 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.473 HG13 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 3.46 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.473 ' H ' HG13 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.95 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.61 113.97 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.508 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.81 111.535 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.74 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' B' ' 26' ' ' LEU . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 4.02 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 4.46 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 5.09 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.85 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 5.35 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 4.09 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.49 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.89 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.56 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.96 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 2.71 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.95 110.335 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.12 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.79 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.65 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.413 ' HB ' ' CB ' ' A' ' 3' ' ' SER . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.8 109.678 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.74 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.38 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 4.18 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.86 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.82 111.688 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 3.18 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.95 110.962 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.67 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 4.11 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.3 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.456 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.48 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . 0.456 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 4.18 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.44 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.51 174.56 7.21 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.43 111.219 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 139.11 58.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 5.68 111.241 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 11.1 t -88.03 131.46 34.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.181 -0.463 . . . . 5.52 110.276 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.326 -0.397 . . . . 6.38 110.863 -179.867 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 80.4 mtp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.154 0.502 . . . . 8.0 110.679 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -113.7 23.74 12.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.873 -0.603 . . . . 9.03 109.969 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.17 -14.35 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.59 -0.732 . . . . 5.01 111.563 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.42 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.54 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 4.61 110.11 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.98 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 4.0 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 3.28 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.405 HG23 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 3.27 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.57 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . 0.421 HD22 ' N4 ' ' F' ' 8' ' ' ' DC' . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.77 109.973 179.339 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . 0.422 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.24 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.655 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.35 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . 0.456 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 3.02 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.81 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . 0.416 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.72 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . 0.416 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.71 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.88 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.24 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.94 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.428 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.63 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.484 HH21 " H3'" ' F' ' 4' ' ' ' DG' . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.48 109.638 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.57 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.35 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . 0.454 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.77 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 4.15 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.58 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . 0.563 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.64 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . 0.454 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.82 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.49 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 3.25 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.44 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.73 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.74 109.017 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 3.02 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.14 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 3.32 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.88 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.59 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.92 109.861 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.51 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 3.37 109.352 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.26 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.71 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 4.02 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.32 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 6.01 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.12 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.7 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 4.11 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.96 109.776 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.94 111.957 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.69 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.92 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.73 110.102 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.99 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.87 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . 0.449 ' HZ2' ' CG ' ' D' ' 11' ' ' ASP . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.65 112.009 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.19 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.563 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.59 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.06 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.488 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 5.29 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.46 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.51 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.93 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.655 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 3.11 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.93 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.31 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.77 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 5.14 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . 0.562 ' HB3' ' N ' ' A' ' 1' ' ' MET . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.98 111.225 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.75 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.422 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 3.33 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.55 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 25' ' ' THR . . . . . 0.452 ' OG1' ' HE2' ' A' ' 2' ' ' LYS . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 4.2 110.466 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 3.28 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 3.04 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.35 110.436 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.81 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.4 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 4.0 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.66 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.51 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.53 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.34 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.73 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . 0.431 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.24 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.19 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 2.0 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.76 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.75 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.68 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 2.45 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.35 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 3.29 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.63 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 3.5 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.415 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.39 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.45 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.95 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.7 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.43 110.462 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 6.55 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 5.0 111.373 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.62 111.873 178.394 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.696 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O4'-C1'-C2' 107.113 0.921 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.696 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 N19-C1'-C2' 117.664 2.165 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.723 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O3'-P-O5' 100.984 -1.587 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.723 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.767 2.458 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.521 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.342 1.927 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.672 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O3'-P-O5' 100.678 -1.748 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.672 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 O4'-C1'-N19 109.807 2.508 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.501 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-N19 109.149 1.686 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.629 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.466 0 O3'-P-O5' 99.803 -2.209 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.629 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O3'-P-O5' 100.729 -1.721 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 109.554 2.192 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.529 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.71 0 O3'-P-O5' 99.62 -2.305 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.529 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O3'-P-O5' 99.667 -2.281 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.774 0 O4'-C1'-N19 109.707 2.384 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.477 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.682 0 O4'-C1'-N19 109.761 2.452 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.477 ' C6 ' H2'' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O3'-P-O5' 99.615 -2.308 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.473 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.79 0 O4'-C1'-N19 109.504 2.131 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.605 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.107 0 O4'-C1'-N19 109.756 2.445 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.805 0 O4'-C1'-N19 109.38 1.975 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.54 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.203 1.754 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.54 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C1'-N19 109.604 2.255 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O4'-C1'-N19 109.687 2.359 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.503 H2'' ' C5 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.845 0 O3'-P-O5' 99.816 -2.202 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.503 ' C5 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.676 0 N19-C1'-C2' 116.828 1.642 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.447 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 116.448 1.405 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.69 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 104.877 -0.723 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.69 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.88 0 N19-C1'-C2' 117.184 1.865 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.597 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 O4'-C1'-N19 110.406 3.258 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . 0.484 " H3'" HH21 ' C' ' 24' ' ' ARG . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.614 2.268 . . . . 4.55 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.452 ' C6 ' H2'' ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 O4'-C1'-N19 109.777 2.471 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.435 ' C7 ' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-N19 109.672 2.34 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.55 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.819 0 O3'-P-O5' 99.693 -2.267 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.55 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 O4'-C1'-N19 109.562 2.202 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.453 ' C6 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.576 2.22 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.484 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 100.114 -2.045 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.484 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-N19 109.577 2.221 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.491 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O3'-P-O5' 99.599 -2.316 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.671 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.424 -0.573 0 O3'-P-O5' 99.861 -2.179 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.671 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 109.796 2.494 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.467 H2'' ' C6 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 99.487 -2.375 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.588 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O3'-P-O5' 99.822 -2.199 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.588 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.804 0 O4'-C1'-N19 109.624 2.28 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.483 " H1'" " H5'" ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 109.809 2.511 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.796 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.945 0 N19-C1'-C2' 118.415 2.635 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.796 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.555 2.194 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.67 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C1'-N19 109.771 2.464 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.701 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 100.648 -1.764 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.701 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O3'-P-O5' 100.871 -1.647 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.681 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 O3'-P-O5' 101.291 -1.426 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.407 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 N19-C1'-C2' 116.219 1.262 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.888 0.375 . . . . 9.79 110.769 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.58 126.93 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.565 -0.532 . . . . 10.89 109.565 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.3 m -89.41 149.99 22.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.299 0.571 . . . . 7.99 112.345 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.62 45.67 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.492 -0.777 . . . . 5.88 111.471 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.533 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . 79.91 58.59 2.79 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.506 -0.854 . . . . 3.69 111.614 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 5' ' ' GLY . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 5.18 109.696 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.443 ' CG1' ' HB3' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.64 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.86 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 3.36 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 3.49 110.452 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.44 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.79 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.91 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.4 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 4.19 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.75 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.404 ' HA ' ' HA ' ' B' ' 15' ' ' ARG . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.95 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.73 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.436 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.93 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.558 ' HB ' ' OP1' ' F' ' 15' ' ' ' DT' . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 4.13 111.212 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.31 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.516 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 4.1 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 3.29 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 4.15 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.55 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.96 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.81 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.53 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 5.43 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.406 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.43 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.49 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 3.39 110.352 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 3.37 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.51 110.634 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.477 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.87 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.501 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.41 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.43 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.68 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.28 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.57 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 3.37 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.6 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.51 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.58 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.79 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' NZ ' ' HA ' ' B' ' 41' ' ' GLU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.58 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.69 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 5.07 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.51 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 7.13 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.78 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 6.49 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m 65.58 91.65 0.08 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.57 111.368 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 . . . . . 0 N--CA 1.466 0.327 0 CA-C-N 115.652 -0.704 . . . . 7.28 111.008 179.701 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.3 tpp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 121.737 0.779 . . . . 10.76 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 40.8 mmtt -82.73 -154.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.167 -0.924 . . . . 9.42 110.245 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' SER . . . . . 0.405 ' HA ' HD11 ' B' ' 6' ' ' ILE . 5.5 m -65.63 87.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.392 0.615 . . . . 6.91 110.799 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.88 78.57 1.17 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.578 -0.737 . . . . 5.83 111.109 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . 0.501 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . 91.62 51.56 2.48 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.509 -0.853 . . . . 4.11 112.837 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' B' ' 3' ' ' SER . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.85 111.096 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 4.04 110.233 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.415 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.88 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.415 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.62 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 4.11 110.062 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.52 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.89 110.166 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 4.23 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.75 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 4.22 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.5 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 3.46 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.95 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.61 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.81 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.74 109.685 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 4.02 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 4.46 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 5.09 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.85 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 5.35 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 4.09 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.49 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.89 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.56 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.96 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.443 ' HB3' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 2.71 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.95 109.487 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.405 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.12 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.79 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.65 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.533 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.8 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.74 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.38 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . 0.423 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 4.18 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.86 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.483 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.82 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 3.18 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.95 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . 0.405 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.67 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 4.11 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.3 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.48 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 4.18 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.44 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt -112.2 98.7 7.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.43 110.621 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -171.07 1.96 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.174 -0.466 . . . . 5.68 110.991 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . 0.462 ' HB3' ' OXT' ' D' ' 55' ' ' GLN . 37.1 m -77.58 62.47 2.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.652 0.739 . . . . 5.52 110.63 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.52 -0.764 . . . . 6.38 110.594 -179.619 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.59 ' SD ' ' HD3' ' C' ' 8' ' ' ARG . 3.2 ptt? . . . . . 0 N--CA 1.456 -0.131 0 N-CA-C 109.712 -0.477 . . . . 8.0 109.712 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -109.39 157.93 18.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.919 0.39 . . . . 9.03 110.605 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' SER . . . . . 0.405 ' OG ' HD12 ' C' ' 22' ' ' LEU . 19.3 m -97.97 43.33 1.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.318 0.58 . . . . 5.01 110.883 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.42 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.54 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . 0.406 HD11 HG21 ' C' ' 6' ' ' ILE . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 4.61 110.748 -178.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.98 110.486 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . 0.59 ' HD3' ' SD ' ' C' ' 1' ' ' MET . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 4.0 110.468 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 3.28 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 3.27 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.57 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.77 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.24 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' D' ' 17' ' ' VAL . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.35 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . 0.469 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 3.02 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.4 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.81 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.72 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.71 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.88 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.24 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . 0.405 HD12 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.94 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.449 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.63 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.48 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.57 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.35 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.77 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 4.15 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.58 110.267 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.64 109.875 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.82 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.49 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 3.25 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.44 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.73 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . 0.568 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.74 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 3.02 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.14 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 3.32 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.88 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.59 110.845 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.92 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.51 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 3.37 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.26 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.71 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 4.02 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.32 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 6.01 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.12 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.7 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 4.11 110.236 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.96 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.568 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.94 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.69 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . 0.489 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.92 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.73 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.99 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.674 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.87 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.65 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.19 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.469 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.59 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.06 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.437 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 5.29 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . 0.449 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.46 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.437 ' CZ ' ' HB2' ' D' ' 13' ' ' LEU . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.93 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.469 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 3.11 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.674 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.93 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.31 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.77 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 5.14 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.98 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.75 110.228 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 3.33 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.55 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 4.2 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 3.28 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 3.04 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.35 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.81 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.4 111.121 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 4.0 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.66 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . 0.573 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.51 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.53 109.739 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.34 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . 0.432 HD12 HG21 ' D' ' 36' ' ' ILE . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.73 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . 0.467 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.24 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.19 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 2.0 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.76 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.75 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.68 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 2.45 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . 0.467 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.35 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 3.29 110.836 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.63 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 3.5 110.498 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.39 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.45 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.95 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.7 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.43 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 6.55 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 5.0 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . 0.462 ' OXT' ' HB3' ' B' ' 54' ' ' CYS . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.62 110.512 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.698 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 107.068 0.88 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.698 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 N19-C1'-C2' 117.44 2.025 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.74 H2'' ' N7 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O3'-P-O5' 100.931 -1.615 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.74 ' N7 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 109.731 2.414 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.459 ' C7 ' H2'' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C1'-N19 109.227 1.784 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.645 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O3'-P-O5' 100.378 -1.906 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.645 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 109.716 2.395 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.465 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.143 1.679 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.698 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.527 0.443 0 O3'-P-O5' 100.141 -2.031 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.698 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 O4'-C1'-N19 109.568 2.21 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.525 H2'' ' C6 ' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.76 0 O4'-C1'-N19 109.504 2.13 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.525 ' C6 ' H2'' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.613 -2.309 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.63 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.864 0 O3'-P-O5' 99.544 -2.345 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.691 0 O4'-C1'-N19 109.386 1.982 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.474 ' C6 ' H2'' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.688 0 O4'-C1'-N19 109.905 2.631 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.441 " H1'" ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 99.88 -2.169 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.647 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.675 0 O3'-P-O5' 99.854 -2.182 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.647 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.963 0 O4'-C1'-N19 109.835 2.544 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.453 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.921 0 O4'-C1'-N19 109.345 1.931 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.449 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.5 2.125 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.5 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.421 2.027 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.5 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.923 0 O4'-C1'-N19 109.663 2.329 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.502 H2'' ' C6 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.676 0 O3'-P-O5' 99.449 -2.395 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.502 ' C6 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.618 0 N19-C1'-C2' 117.317 1.948 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.46 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.595 -1.002 0 N19-C1'-C2' 116.269 1.293 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.709 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O5'-C5'-C4' 111.589 0.992 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.709 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.954 0 N19-C1'-C2' 116.976 1.735 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.565 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 110.224 3.03 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . 0.459 H2'' ' C7 ' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.587 2.234 . . . . 4.55 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.473 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C1'-N19 110.039 2.798 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.473 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 109.936 2.67 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.43 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O3'-P-O5' 99.447 -2.396 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.591 H2'' ' C5 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.477 0 O3'-P-O5' 100.145 -2.029 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.591 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.055 2.818 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.418 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.51 2.138 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.798 0 O3'-P-O5' 99.924 -2.145 . . . . 3.72 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.608 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.78 0 O3'-P-O5' 99.951 -2.131 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.608 ' C8 ' H2'' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.811 2.514 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.604 H2'' ' C7 ' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.418 -1.002 0 O3'-P-O5' 99.214 -2.519 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.604 ' C7 ' H2'' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 110.048 2.81 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.658 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.931 0 N19-C1'-C2' 118.168 2.48 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.658 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.425 3.282 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.42 " H1'" " H5'" ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.422 -0.684 0 O3'-P-O5' 99.057 -2.602 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.905 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.999 0 N19-C1'-C2' 118.093 2.433 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.905 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 109.332 1.915 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.667 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.484 2.106 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.693 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.679 0 O3'-P-O5' 100.233 -1.983 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.693 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.159 1.85 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.628 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.711 0 O4'-C4'-C3' 104.444 -1.156 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 N19-C1'-C2' 116.523 1.452 . . . . 4.98 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.818 0.342 . . . . 9.79 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -106.22 167.98 9.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.178 0.513 . . . . 10.89 111.458 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.4 2.88 3.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.233 -0.894 . . . . 7.99 112.108 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -20.0 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.041 0.448 . . . . 5.88 110.884 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.511 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . 105.5 139.11 9.6 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.759 -0.734 . . . . 3.69 112.473 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 5.18 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.64 109.905 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.86 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 3.36 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 3.49 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.442 ' C ' ' H ' ' A' ' 13' ' ' LEU . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.44 110.527 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.79 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.442 ' H ' ' C ' ' A' ' 11' ' ' ASP . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.91 110.785 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.429 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.4 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.456 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 4.19 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.528 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.75 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.95 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.73 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.93 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 4.13 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.31 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 4.1 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.517 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 3.29 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 4.15 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.55 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.96 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.81 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.53 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 5.43 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.43 111.32 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.49 110.965 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 3.39 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 3.37 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 46' ' ' LYS . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.51 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.87 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.41 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.43 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.68 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.28 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.57 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 3.37 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.6 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.51 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.58 111.058 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.79 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.58 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.69 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 5.07 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.51 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 7.13 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.78 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 6.49 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t -77.78 99.26 5.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.57 110.102 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.712 -0.676 . . . . 7.28 111.443 -179.343 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mmm . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.095 0.474 . . . . 10.76 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 96.14 4.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.008 -0.542 . . . . 9.42 110.599 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.77 88.7 4.01 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.017 -0.538 . . . . 6.91 111.318 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -89.98 95.34 10.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.244 0.545 . . . . 5.83 110.723 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.26 50.98 2.86 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.11 111.272 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.85 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 4.04 109.699 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.88 110.952 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.62 110.673 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 4.11 111.361 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.52 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.89 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 4.23 109.92 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.75 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 4.22 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.528 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.5 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.456 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 3.46 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.95 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.61 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.484 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.81 111.722 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.74 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 4.02 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 4.46 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 5.09 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.85 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 5.35 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . 0.429 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 4.09 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . 0.476 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.49 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.89 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.56 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.96 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.476 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 2.71 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.95 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.12 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.511 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.79 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.65 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.8 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.74 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.38 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 4.18 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.86 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.82 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 3.18 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.533 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.95 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.67 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 4.11 111.156 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.3 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.48 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 4.18 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.44 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 85.5 mmm -85.68 -176.22 5.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.43 110.384 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.77 142.63 55.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.058 0.456 . . . . 5.68 111.753 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 62.8 m -87.13 162.46 17.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.826 -0.625 . . . . 5.52 110.326 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.766 -0.197 . . . . 6.38 110.676 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 58.0 mtp . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.216 0.531 . . . . 8.0 110.42 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -132.49 29.13 4.27 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.666 -0.697 . . . . 9.03 109.414 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -24.09 67.58 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.696 -0.684 . . . . 5.01 111.606 -178.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' THR . . . . . 0.431 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.42 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.54 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 4.61 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.98 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 4.0 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 3.28 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 3.27 108.696 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.57 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.77 109.909 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.24 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.407 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.35 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 3.02 109.858 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.81 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.72 109.792 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.71 110.919 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.88 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.24 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.94 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.63 109.851 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' C' ' 24' ' ' ARG . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.48 110.583 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.57 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.35 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . 0.418 HD11 HG22 ' C' ' 28' ' ' ILE . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.77 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 4.15 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.58 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.64 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . 0.475 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.82 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.49 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 3.25 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.44 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.73 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.74 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 3.02 111.767 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.14 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 3.32 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.88 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.59 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.92 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.51 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 3.37 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.26 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.71 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 4.02 109.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.32 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 6.01 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.12 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.7 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 4.11 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.96 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.94 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.69 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.92 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.73 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.99 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.551 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.87 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . 0.551 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.65 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.51 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.19 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.59 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.43 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.06 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 5.29 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . 0.51 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.46 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.93 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 3.11 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.93 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.31 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.77 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . 0.408 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 5.14 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.98 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.75 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 3.33 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.55 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 4.2 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 3.28 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 3.04 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . 0.41 HG21 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.35 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.81 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.4 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 4.0 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.66 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.51 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.53 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.34 108.302 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.73 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.24 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.19 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 2.0 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.76 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.75 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.68 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 2.45 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.35 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 3.29 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.63 111.167 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 3.5 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.41 ' CE1' HG21 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.39 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.45 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.95 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.7 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.43 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 6.55 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 5.0 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.62 111.145 179.78 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.693 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.693 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.627 2.142 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.666 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-N19 109.343 1.929 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.621 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-N19 109.469 2.086 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.494 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.445 2.056 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.687 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 100.219 -1.99 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.687 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 109.624 2.28 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.501 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-N19 109.091 1.613 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.633 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.601 -0.482 0 O4'-C1'-N19 109.563 2.203 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.633 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.516 2.145 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.417 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 109.758 2.448 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.581 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 O4'-C1'-N19 109.761 2.451 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.581 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C1'-N19 109.607 2.259 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.492 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.614 2.268 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.474 H2'' ' C7 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 110.031 2.788 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.474 ' C7 ' H2'' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.639 0 O4'-C1'-N19 109.624 2.28 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.483 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O4'-C1'-N19 109.385 1.981 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.552 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.633 0 O4'-C1'-N19 109.734 2.417 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.552 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C1'-N19 109.425 2.032 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.543 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.445 2.057 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.482 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 O4'-C1'-N19 109.46 2.075 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.482 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.783 2.478 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.464 H2'' ' C5 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 O3'-P-O5' 99.768 -2.227 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.464 ' C5 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O3'-P-O5' 100.838 -1.664 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.417 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.9 0 N19-C1'-C2' 116.419 1.387 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.716 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O5'-C5'-C4' 111.362 0.83 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.716 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.621 1.143 0 N19-C1'-C2' 116.68 1.55 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.564 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 110.212 3.015 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . 0.455 H2'' ' C7 ' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.094 0 O3'-P-O5' 99.471 -2.383 . . . . 4.55 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.455 ' C7 ' H2'' ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 109.605 2.257 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.44 H2'' ' C7 ' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O3'-P-O5' 99.404 -2.419 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.519 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O3'-P-O5' 99.508 -2.364 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.539 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O3'-P-O5' 99.704 -2.261 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.539 ' C6 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 O4'-C1'-N19 109.591 2.239 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.495 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.757 2.446 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.927 -2.144 . . . . 3.72 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.697 2.372 . . . . 3.8 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.577 H2'' ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.857 -2.18 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.577 ' C8 ' H2'' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.859 0 O4'-C1'-N19 109.921 2.652 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.43 H2'' ' C6 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C1'-N19 109.64 2.3 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.624 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O3'-P-O5' 99.401 -2.42 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.624 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.873 0 O4'-C1'-N19 109.721 2.401 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.428 ' C6 ' H2'' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.865 0 O3'-P-O5' 99.261 -2.494 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.865 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.074 0 N19-C1'-C2' 118.004 2.377 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.865 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-N19 109.453 2.066 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.659 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 109.422 2.028 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.578 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-N19 109.312 1.89 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.615 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O3'-P-O5' 100.494 -1.845 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.615 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 101.312 -1.415 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.434 ' C5 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 116.225 1.266 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 tpt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.151 -0.314 . . . . 9.79 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -92.27 -9.81 40.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 10.89 111.107 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 m -67.34 111.21 3.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.244 -0.435 . . . . 7.99 110.474 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m -93.51 -36.37 12.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.065 -0.516 . . . . 5.88 111.329 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.53 105.93 2.95 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.832 -0.699 . . . . 3.69 111.396 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 5.18 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.4 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.64 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.86 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 3.36 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 3.49 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.53 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.44 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.79 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.53 ' HB2' ' OD2' ' A' ' 11' ' ' ASP . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.91 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.479 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.4 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.472 ' HG2' ' CG ' ' A' ' 11' ' ' ASP . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 4.19 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.75 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.95 110.182 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.73 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.93 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.405 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 4.13 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.31 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 4.1 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 3.29 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 4.15 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.55 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.96 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.81 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.53 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 5.43 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.43 110.932 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.49 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 3.39 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 3.37 111.251 -179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.405 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.51 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.87 110.322 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.453 ' HH ' ' H ' ' B' ' 4' ' ' THR . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.41 111.155 -179.345 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.43 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.68 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.28 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.57 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.437 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 3.37 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.444 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.6 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.437 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.51 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.58 109.253 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.79 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.58 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.69 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 5.07 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.51 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 7.13 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.78 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 6.49 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m -115.72 12.8 16.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.57 109.997 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 C--O 1.237 0.403 0 CA-C-N 115.689 -0.687 . . . . 7.28 110.334 -179.939 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.182 0.515 . . . . 10.76 110.225 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -95.93 61.27 2.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.671 -0.695 . . . . 9.42 110.088 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.49 101.13 0.56 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.713 -0.676 . . . . 6.91 110.762 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.453 ' H ' ' HH ' ' A' ' 37' ' ' TYR . 0.2 OUTLIER -96.1 57.34 1.75 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 5.83 110.992 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.45 159.68 28.16 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.711 -0.757 . . . . 4.11 112.122 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.85 110.204 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 4.04 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.88 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.62 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 4.11 110.093 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.52 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.89 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 4.23 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . 0.469 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.75 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 4.22 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.5 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 3.46 111.618 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.95 110.048 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.61 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.427 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.81 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.74 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 4.02 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.479 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 4.46 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.427 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 5.09 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.85 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 5.35 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 4.09 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.49 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.89 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.56 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.96 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 2.71 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.95 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.12 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.436 HD11 HG21 ' B' ' 36' ' ' ILE . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.79 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.65 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.8 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.74 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.38 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 4.18 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.86 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.82 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 3.18 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.508 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.95 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . 0.5 ' HZ2' ' CD ' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.67 110.866 -179.488 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 4.11 110.356 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.3 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.48 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 4.18 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.44 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt -79.92 57.03 2.49 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.43 110.881 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -38.49 74.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.767 -0.652 . . . . 5.68 111.12 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -161.95 74.5 0.44 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.026 -0.534 . . . . 5.52 110.78 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.162 -0.472 . . . . 6.38 110.666 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 121.16 0.505 . . . . 8.0 110.408 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -110.06 111.16 22.35 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.909 -0.587 . . . . 9.03 110.787 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -90.57 9.77 28.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.585 -0.734 . . . . 5.01 110.921 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.42 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.54 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 4.61 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.98 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 4.0 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 3.28 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 3.27 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.57 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . 0.533 HD23 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.77 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.24 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.35 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 3.02 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.81 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.72 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.71 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . 0.528 ' HA ' ' OP1' ' F' ' 5' ' ' ' DT' . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.88 111.03 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.24 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.94 111.433 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.514 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.63 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' C' ' 24' ' ' ARG . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.48 111.418 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.57 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.35 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.77 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 4.15 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.58 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.64 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.82 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.49 110.554 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 3.25 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.44 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.73 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.74 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 3.02 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.14 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 3.32 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.88 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.59 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.92 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.51 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 3.37 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.26 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.71 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 4.02 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.32 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 6.01 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.12 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.7 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 4.11 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.96 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.409 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.94 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.69 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.92 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.73 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.99 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.87 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.65 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.19 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.54 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.59 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.06 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.54 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 5.29 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . 0.514 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.46 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.533 HH11 HD23 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.93 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 3.11 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.49 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.93 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.31 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.77 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 5.14 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.98 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . 0.409 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.75 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 3.33 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.55 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 4.2 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 3.28 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 3.04 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . 0.487 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.35 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . 0.469 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.81 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.4 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 4.0 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.66 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.51 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.53 110.261 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.34 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.73 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.24 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.19 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.614 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 2.0 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.76 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.75 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.68 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 2.45 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.35 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . 0.443 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 3.29 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.63 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 3.5 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.39 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.45 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.95 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.7 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.43 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 6.55 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 5.0 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.62 110.041 -179.055 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.674 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 106.992 0.811 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.712 H2'' ' N7 ' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 N19-C1'-C2' 116.915 1.697 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.712 ' N7 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 O4'-C1'-N19 109.347 1.934 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.671 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.207 1.758 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.721 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 109.173 1.716 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.721 ' C5 ' H2'' ' E' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 117.319 1.949 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.522 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O4'-C1'-N19 109.328 1.91 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-N19 109.597 2.246 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.666 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.877 -2.17 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.666 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C1'-N19 109.201 1.752 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.552 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.574 2.218 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.557 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.77 0 O4'-C1'-N19 109.656 2.32 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.557 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.664 0 O3'-P-O5' 99.566 -2.334 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.688 0 O4'-C1'-N19 109.685 2.356 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.479 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.777 0 O4'-C1'-N19 109.72 2.4 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.479 ' C6 ' H2'' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.738 0 O4'-C1'-N19 109.555 2.193 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.431 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-N19 109.913 2.641 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.498 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.695 0 O4'-C1'-N19 109.675 2.344 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.599 -0.68 0 O4'-C1'-N19 109.673 2.341 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.555 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.728 0 O3'-P-O5' 100.029 -2.09 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.555 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.595 2.244 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.413 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O3'-P-O5' 99.821 -2.2 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.473 H2'' ' C6 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.663 0 O4'-C1'-N19 109.761 2.451 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.473 ' C6 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.765 0 O3'-P-O5' 100.486 -1.849 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.46 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.776 0 N19-C1'-C2' 116.087 1.18 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.689 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.595 0 O4'-C1'-N19 108.67 1.088 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.689 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.666 0 N19-C1'-C2' 116.844 1.652 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.603 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 O4'-C1'-N19 110.252 3.065 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-N19 109.943 2.679 . . . . 4.55 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.528 ' OP1' ' HA ' ' C' ' 20' ' ' ILE . . . . . . . . 0 O5'--C5' 1.431 -0.531 0 O3'-P-O5' 99.867 -2.175 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.506 H2'' ' C7 ' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-N19 109.716 2.395 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.506 ' C7 ' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O3'-P-O5' 99.894 -2.161 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.46 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 100.05 -2.079 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.451 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.841 2.551 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.472 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.548 -2.343 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.472 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-N19 109.684 2.355 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.503 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-N19 109.706 2.382 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.705 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 O3'-P-O5' 99.933 -2.141 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.705 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.984 2.73 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.458 H2'' ' C6 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O3'-P-O5' 99.417 -2.412 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.542 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.825 0 O3'-P-O5' 99.687 -2.27 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.542 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O4'-C1'-N19 109.676 2.345 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.542 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.421 -0.766 0 O3'-P-O5' 99.164 -2.545 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.542 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.757 0 O3'-P-O5' 99.016 -2.623 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.846 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 100.022 -2.094 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.846 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.176 0 O4'-C1'-N19 109.949 2.687 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.477 H2'' ' C6 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O3'-P-O5' 100.404 -1.893 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.867 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.528 0.529 0 N19-C1'-C2' 117.389 1.993 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.867 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 104.432 -1.168 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.504 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 116.561 1.476 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 110.14 -0.318 . . . . 9.79 110.14 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -99.46 104.8 16.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.228 0.537 . . . . 10.89 111.249 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 m -112.99 148.31 35.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.471 -0.786 . . . . 7.99 109.036 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.04 -97.2 0.13 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.913 0.338 . . . . 5.88 111.913 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -125.97 118.79 3.26 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.597 -0.811 . . . . 3.69 112.362 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 5.18 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.64 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.86 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 3.36 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.417 HG21 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 3.49 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.44 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.79 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.91 111.499 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.4 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' CZ ' ' HB2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 4.19 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.426 HG11 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.75 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.95 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.73 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.93 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 4.13 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.31 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 4.1 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 3.29 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 4.15 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.55 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.96 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.81 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.53 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 5.43 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.43 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.49 110.208 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 3.39 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 3.37 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.51 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.87 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.41 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.43 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.68 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.28 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.497 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.57 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.497 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 3.37 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.6 108.807 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.51 111.33 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.58 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.79 109.872 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.58 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.571 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.69 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 5.07 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.571 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.51 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 7.13 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.78 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.547 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 6.49 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m -86.58 95.95 9.93 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.57 109.845 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.04 -0.527 . . . . 7.28 110.381 -179.741 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.572 0.225 . . . . 10.76 110.452 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' B' ' 21' ' ' GLU . 5.6 ptpt -154.37 152.85 30.69 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.303 -0.408 . . . . 9.42 110.143 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 7.3 m -121.48 15.65 11.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.13 0.491 . . . . 6.91 110.143 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.28 -179.2 6.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.51 -0.768 . . . . 5.83 110.926 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.85 126.69 17.96 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.683 -0.77 . . . . 4.11 111.272 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.85 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 4.04 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.88 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.62 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 4.11 109.542 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.52 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.89 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 4.23 109.802 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.75 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 4.22 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.426 ' HB ' HG11 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.5 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 3.46 111.531 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.95 109.172 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.61 113.109 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . 0.4 HG12 H5'' ' E' ' 7' ' ' ' DG' . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.81 112.625 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' B' ' 2' ' ' LYS . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.74 111.872 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 4.02 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 4.46 111.146 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 5.09 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.85 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 5.35 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 4.09 111.268 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.49 111.406 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.89 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.56 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.96 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.417 ' O ' HG21 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 2.71 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.95 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.12 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.79 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.65 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.8 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.74 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.38 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 4.18 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.86 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.82 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 3.18 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.95 109.787 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.67 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 4.11 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.3 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.48 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 4.18 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.44 111.422 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.42 127.41 12.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.43 110.289 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.21 153.96 39.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.841 0.353 . . . . 5.68 111.027 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.46 145.44 41.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 5.52 110.875 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.557 -0.292 . . . . 6.38 110.382 179.748 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 CA--C 1.517 -0.314 0 CA-C-O 120.795 0.331 . . . . 8.0 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -67.22 143.02 56.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.763 -0.653 . . . . 9.03 109.947 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -130.08 39.14 3.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.414 0.626 . . . . 5.01 110.038 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.42 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.54 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 4.61 110.054 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.98 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 4.0 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 3.28 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 3.27 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.57 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.77 110.95 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.24 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.35 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 3.02 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.81 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.72 109.602 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.71 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.88 111.421 -179.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.24 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . 0.61 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.94 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.425 HH12 H5'' ' F' ' 4' ' ' ' DG' . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.63 110.818 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.48 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.57 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.35 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.77 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 4.15 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.58 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . 0.498 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.64 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.82 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.49 110.899 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 3.25 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.685 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.44 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.73 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.74 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 3.02 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.14 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 3.32 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.88 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.59 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . 0.685 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.92 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.51 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 3.37 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.26 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.71 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 4.02 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.32 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 6.01 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.12 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.7 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 1' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 4.11 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.96 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.94 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.69 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.92 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.73 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.99 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.437 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.87 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.65 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.408 ' HB ' ' H ' ' D' ' 11' ' ' ASP . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.19 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.529 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.59 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.498 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.06 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.404 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 5.29 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.46 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.529 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.93 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 3.11 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.93 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.31 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.77 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . 0.519 HG12 " H3'" ' E' ' 16' ' ' ' DT' . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 5.14 110.522 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.98 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.75 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 3.33 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.55 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 4.2 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 3.28 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 3.04 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.35 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.81 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.424 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.4 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 4.0 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.66 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.51 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.53 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.34 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.73 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.24 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.19 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 2.0 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.76 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.75 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.68 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 2.45 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.35 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 3.29 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.408 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.63 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 3.5 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.39 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.45 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.95 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.7 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.43 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 6.55 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 5.0 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.62 109.564 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.673 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 108.628 1.034 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.673 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 N19-C1'-C2' 117.058 1.786 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.676 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 O4'-C1'-N19 109.32 1.9 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.676 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.217 1.771 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.55 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O3'-P-O5' 100.636 -1.77 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.58 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O3'-P-O5' 100.478 -1.854 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.58 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C1'-N19 109.363 1.954 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.49 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O3'-P-O5' 100.183 -2.009 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.718 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.669 0 O3'-P-O5' 99.775 -2.223 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.718 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 O4'-C1'-N19 109.489 2.111 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.451 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.476 2.094 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.551 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.647 0 O4'-C1'-N19 109.808 2.51 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.551 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O4'-C1'-N19 109.498 2.122 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.47 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.668 2.335 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.413 ' C7 ' H2'' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.721 2.402 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.623 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.715 0 O3'-P-O5' 99.449 -2.395 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.623 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-N19 109.931 2.664 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.46 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.121 0 O4'-C1'-N19 109.643 2.303 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.553 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.8 0 O3'-P-O5' 100.587 -1.797 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.553 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 O4'-C1'-N19 109.475 2.094 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.62 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C1'-N19 109.382 1.977 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.62 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 110.157 2.946 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.498 H2'' ' C7 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-N19 109.544 2.18 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.498 ' C7 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 N19-C1'-C2' 116.714 1.571 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.482 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 N19-C1'-C2' 115.878 1.049 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.705 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C4'-C3' 104.846 -0.754 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.705 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 N19-C1'-C2' 116.947 1.717 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.529 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 110.167 2.958 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . 0.516 H2'' ' C6 ' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.954 0 O3'-P-O5' 99.852 -2.183 . . . . 4.55 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.516 ' C6 ' H2'' ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.955 0 O4'-C1'-N19 109.992 2.74 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.519 H2'' ' C7 ' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.65 0 O3'-P-O5' 98.925 -2.671 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.519 ' C7 ' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O4'-C1'-N19 109.729 2.411 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.445 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 99.354 -2.445 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.67 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.779 -2.221 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.67 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O3'-P-O5' 100.372 -1.909 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.434 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.668 2.335 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.468 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.081 0 O3'-P-O5' 99.254 -2.498 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.631 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.67 0 O3'-P-O5' 99.507 -2.365 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.631 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.061 0 O4'-C1'-N19 109.83 2.538 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.476 ' H73' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.697 0 O3'-P-O5' 99.995 -2.108 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.632 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.951 0 N19-C1'-C2' 118.018 2.386 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.632 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.814 0 O4'-C1'-N19 110.099 2.873 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.451 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O3'-P-O5' 99.483 -2.377 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.695 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.662 0 O3'-P-O5' 99.311 -2.468 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.695 ' C8 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.758 0 O3'-P-O5' 100.183 -2.009 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.977 0 O4'-C1'-N19 109.59 2.237 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.673 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O3'-P-O5' 100.474 -1.856 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.673 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O3'-P-O5' 100.685 -1.745 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.673 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 101.431 -1.352 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.424 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.447 1.404 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mmm . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.869 0.366 . . . . 9.79 110.498 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.44 81.6 7.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.488 . . . . 10.89 110.112 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.0 m -96.57 36.95 1.31 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.952 -0.567 . . . . 7.99 111.274 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.99 50.37 1.86 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.345 0.593 . . . . 5.88 109.549 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.33 56.48 0.83 Allowed Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.69 110.216 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 5.18 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.64 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.86 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 3.36 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 3.49 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.448 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.44 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.79 109.993 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.91 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.4 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.448 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 4.19 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.482 HG23 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.75 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.482 ' H ' HG23 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.95 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.73 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.597 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.93 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.431 ' HB ' " H4'" ' F' ' 14' ' ' ' DA' . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 4.13 111.277 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.31 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 4.1 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.597 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 3.29 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 4.15 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.433 HG22 ' H1 ' ' D' ' 1' ' ' MET . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.55 111.141 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.96 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.81 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.53 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 5.43 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.43 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.49 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 3.39 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 3.37 110.671 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.51 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.426 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.87 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.41 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.43 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.68 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.28 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.57 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 3.37 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.6 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.429 HD12 HG23 ' A' ' 44' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.51 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.58 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.79 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.58 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.69 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 5.07 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.562 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.51 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 7.13 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.78 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 6.49 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.562 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t 65.15 -90.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.57 111.216 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.645 0.259 . . . . 7.28 110.569 -179.547 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.262 0.553 . . . . 10.76 109.801 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -73.45 120.68 19.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.499 -0.773 . . . . 9.42 109.785 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.8 m -62.52 141.0 58.63 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.157 -0.474 . . . . 6.91 111.556 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.64 76.61 4.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.19 0.519 . . . . 5.83 110.906 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 149.85 68.7 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.577 -0.738 . . . . 4.11 111.345 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . 0.426 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.85 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 4.04 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.88 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.62 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 4.11 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.52 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.89 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.408 HD23 ' N ' ' B' ' 13' ' ' LEU . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 4.23 110.363 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.75 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 4.22 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.5 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 3.46 111.201 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.95 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.61 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.81 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.74 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 4.02 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 4.46 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 5.09 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.85 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 5.35 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 4.09 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.49 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.89 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.56 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.96 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 2.71 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.95 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 49' ' ' LYS . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.12 110.332 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.79 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.65 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.8 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.74 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.38 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 4.18 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.86 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.82 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.461 HD12 HG23 ' B' ' 44' ' ' ILE . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 3.18 110.659 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.95 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.67 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 4.11 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.3 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' B' ' 35' ' ' GLU . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.48 110.438 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 4.18 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.44 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt -82.95 155.6 23.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.43 110.443 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 4.1 m -67.19 126.09 28.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 5.68 111.427 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' D' ' 54' ' ' CYS . 0.0 OUTLIER -69.79 118.51 12.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.425 -0.583 . . . . 5.52 109.425 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 116.284 -0.416 . . . . 6.38 111.081 -179.03 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 6.5 tpt . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.618 0.247 . . . . 8.0 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -144.44 122.11 11.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.008 0.433 . . . . 9.03 110.937 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -129.76 113.39 14.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.192 -0.458 . . . . 5.01 110.15 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.42 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.54 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 4.61 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.98 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . 0.441 ' HD3' ' OP1' ' F' ' 6' ' ' ' DT' . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 4.0 110.104 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 3.28 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.518 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 3.27 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.57 109.178 178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.77 111.652 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.24 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.35 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 3.02 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.402 HG21 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.81 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.72 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . 0.531 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.71 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . 0.43 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.88 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.24 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . 0.531 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.94 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.63 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . 0.43 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.48 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' THR . . . . . 0.414 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.57 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.35 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.77 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 4.15 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.58 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.64 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.82 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.49 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 3.25 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.477 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.44 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.73 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.74 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' D' ' 3' ' ' SER . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 3.02 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.14 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 3.32 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.88 109.801 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.59 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.92 109.768 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.51 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 3.37 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.26 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . 0.464 ' HZ1' ' CD ' ' C' ' 35' ' ' GLU . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.71 109.588 -179.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 4.02 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.32 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 6.01 110.034 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.12 111.437 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.7 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 1' ' ' MET . . . . . 0.433 ' H1 ' HG22 ' A' ' 25' ' ' THR . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 4.11 110.253 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.96 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.497 ' O ' HG23 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.94 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.69 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.92 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.73 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.99 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.87 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.65 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.405 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.19 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.564 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.59 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.564 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.06 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 5.29 111.386 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.46 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.502 ' CZ ' ' H73' ' F' ' 6' ' ' ' DT' . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.93 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 3.11 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.93 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.31 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . 0.575 ' HB3' ' OP1' ' E' ' 16' ' ' ' DT' . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.77 113.745 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 5.14 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.98 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.75 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 3.33 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.55 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 4.2 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 3.28 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 3.04 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.35 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.81 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.4 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 4.0 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.66 110.509 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.51 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.53 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . 0.412 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.34 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.73 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.24 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.19 110.637 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.625 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 2.0 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.76 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.75 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.625 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.68 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 2.45 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.35 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 3.29 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.63 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 3.5 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.39 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.45 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.95 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.7 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 52' ' ' MET . . . . . 0.422 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.43 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 53' ' ' THR . . . . . 0.402 ' H ' ' C ' ' D' ' 51' ' ' ASN . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 6.55 110.619 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' B' ' 54' ' ' CYS . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 5.0 110.626 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.62 109.913 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.699 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.434 -0.368 0 O4'-C1'-N19 108.582 0.978 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.699 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.865 0 N19-C1'-C2' 117.363 1.977 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.696 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O3'-P-O5' 100.695 -1.74 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.696 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -0.994 0 O4'-C1'-N19 109.501 2.126 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.516 ' C7 ' H2'' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 O4'-C1'-N19 109.481 2.101 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.705 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.579 0 N19-C1'-C2' 117.084 1.803 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.705 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 109.775 2.469 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-N19 109.388 1.984 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.742 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.424 0 O3'-P-O5' 100.057 -2.075 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.742 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O4'-C1'-N19 109.547 2.183 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.474 H2'' ' C7 ' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-N19 109.438 2.047 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.549 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-N19 109.67 2.337 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.549 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 99.448 -2.396 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.448 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 109.658 2.322 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.518 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-N19 109.708 2.385 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.575 ' OP1' ' HB3' ' D' ' 19' ' ' PRO . . . . . . . . 0 P--O3' 1.598 -0.72 0 O4'-C1'-N19 109.724 2.405 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.481 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.855 0 O4'-C1'-N19 109.555 2.193 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.481 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.964 0 O4'-C1'-N19 109.581 2.227 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.578 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.454 0 O4'-C1'-N19 109.193 1.741 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C1'-N19 109.445 2.056 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.497 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-N19 109.429 2.037 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.764 2.455 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.475 H2'' ' C7 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.581 0 O3'-P-O5' 99.988 -2.112 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.475 ' C7 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 100.402 -1.894 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.467 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.846 0 N19-C1'-C2' 116.479 1.425 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.744 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.625 0 O5'-C5'-C4' 111.635 1.025 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.744 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.622 1.212 0 N19-C1'-C2' 116.914 1.696 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.538 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-N19 109.806 2.507 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . 0.441 H2'' ' C6 ' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.727 0 O4'-C1'-N19 109.709 2.386 . . . . 4.55 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.522 H2'' ' C7 ' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.623 0 O4'-C1'-N19 109.834 2.543 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.522 ' C7 ' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 O4'-C1'-N19 109.593 2.242 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.447 ' C7 ' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 O3'-P-O5' 99.105 -2.576 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.467 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.915 0 O3'-P-O5' 98.916 -2.676 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.493 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O4'-C1'-N19 109.599 2.249 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.494 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.562 0 O3'-P-O5' 99.803 -2.209 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.494 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.629 2.286 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.45 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.885 0 O3'-P-O5' 99.51 -2.363 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.712 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.656 0 O3'-P-O5' 99.528 -2.354 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.712 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 110.107 2.884 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.451 " H5'" " H1'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.881 0 O3'-P-O5' 99.379 -2.432 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.714 H2'' ' N7 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.592 -1.218 0 N19-C1'-C2' 117.819 2.262 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.714 ' N7 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.011 0 O4'-C1'-N19 110.479 3.349 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.408 ' H72' H2'' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.423 -0.649 0 O3'-P-O5' 99.096 -2.581 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.903 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.804 0 N19-C1'-C2' 117.757 2.223 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.903 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 109.638 2.298 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.51 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.64 0 O3'-P-O5' 100.414 -1.887 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.701 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.87 -2.174 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.701 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 N19-C1'-C2' 117.339 1.962 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.617 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 O4'-C4'-C3' 104.425 -1.175 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.092 1.182 . . . . 4.98 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.475 0.825 0 N-CA-C 109.937 -0.394 . . . . 9.79 109.937 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HZ2' ' CD ' ' A' ' 21' ' ' GLU . 20.8 tptp -64.85 132.13 48.63 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 109.355 -0.609 . . . . 10.89 109.355 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.07 24.1 3.45 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 111.981 0.363 . . . . 7.99 111.981 -178.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 m -102.83 65.18 0.89 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.246 0.546 . . . . 5.88 111.9 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.21 68.68 1.45 Allowed Glycine 0 N--CA 1.452 -0.252 0 CA-C-N 115.913 -0.585 . . . . 3.69 113.267 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 5.18 110.679 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.64 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.86 109.936 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 3.36 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.487 ' CG2' ' HA ' ' B' ' 31' ' ' LYS . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 3.49 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.44 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.79 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.91 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.4 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 4.19 110.383 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.75 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.95 110.927 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.73 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.93 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.48 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 4.13 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.449 ' CD ' ' HZ2' ' A' ' 2' ' ' LYS . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.31 110.452 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 4.1 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 3.29 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 4.15 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.55 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.96 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.81 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.53 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 5.43 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' A' ' 31' ' ' LYS . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.43 110.614 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 30' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.49 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 3.39 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 3.37 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.51 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.87 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.41 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.43 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.68 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.28 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.57 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 3.37 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.6 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.51 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.58 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.79 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.58 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.69 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 5.07 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.51 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 7.13 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.78 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 6.49 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m 71.41 -63.22 0.43 Allowed 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.57 110.12 -178.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.388 . . . . 7.28 110.27 179.608 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.4 ptt? . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.67 0.271 . . . . 10.76 110.667 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttt 56.44 -107.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.642 -0.708 . . . . 9.42 110.316 -178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 6.7 m 55.47 39.34 31.08 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.968 0.414 . . . . 6.91 111.418 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -87.79 171.69 10.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.248 -0.433 . . . . 5.83 110.369 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.69 81.38 1.34 Allowed Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.11 111.019 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.85 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 4.04 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.88 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.62 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 4.11 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . 0.467 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.52 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.48 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.89 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 4.23 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.75 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 4.22 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.5 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 3.46 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.95 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.61 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.81 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.521 ' HG2' ' OP1' ' E' ' 5' ' ' ' DT' . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.74 111.227 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 4.02 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 4.46 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 5.09 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.85 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 5.35 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 4.09 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.49 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.89 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.56 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.487 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.96 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.437 ' H ' HG21 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 2.71 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.95 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.12 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.79 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.65 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 42' ' ' LYS . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.8 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.74 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.38 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 4.18 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.86 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.82 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 3.18 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.411 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.95 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . 0.403 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.67 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 4.11 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.3 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.48 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 4.18 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.44 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm -142.08 18.06 2.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.43 109.812 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.71 96.89 3.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.727 -0.67 . . . . 5.68 111.688 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 29.7 m 71.5 -44.66 0.6 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.609 0.763 . . . . 5.52 112.788 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 120.674 0.273 . . . . 6.38 110.67 -179.758 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.151 0.5 . . . . 8.0 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -122.86 136.67 54.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.948 -0.569 . . . . 9.03 109.912 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -101.98 -74.4 0.63 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.562 -0.29 . . . . 5.01 110.591 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.42 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.54 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 4.61 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.98 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 4.0 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 3.28 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 3.27 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . 0.684 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.57 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.77 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . 0.576 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.24 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.684 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.35 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . 0.511 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 3.02 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.81 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.72 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.71 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.88 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . 0.443 ' HG2' ' OP1' ' F' ' 5' ' ' ' DT' . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.24 109.537 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.94 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.63 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.48 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.57 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.35 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.77 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 4.15 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . 0.465 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.58 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.64 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.82 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.49 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 3.25 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.44 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.73 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.74 108.763 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 3.02 111.883 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . 0.486 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.14 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 3.32 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.88 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.59 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.92 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . 0.467 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.51 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 3.37 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.26 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.71 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 4.02 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.32 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 6.01 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.12 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.7 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 4.11 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . 0.495 ' H ' HD13 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.96 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.94 111.87 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.69 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.92 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . 0.495 HD13 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.73 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.99 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.87 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . 0.4 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.65 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.496 ' CG1' ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.19 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.496 ' H ' ' CG1' ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.59 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.06 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.403 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 5.29 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.46 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.403 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.93 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.511 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 3.11 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.93 110.788 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . 0.445 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.31 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . 0.61 ' HA ' ' OP1' ' E' ' 15' ' ' ' DT' . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.77 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 5.14 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.98 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.75 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.576 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 3.33 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.55 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 4.2 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 3.28 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 3.04 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.35 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.81 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.497 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.4 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 4.0 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.66 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.51 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.53 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.34 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.73 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.24 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.19 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 2.0 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.76 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.75 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.68 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 2.45 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.35 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 3.29 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . 0.411 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.63 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 3.5 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.39 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.45 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.95 111.258 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.7 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.43 110.33 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 6.55 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 5.0 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.62 110.153 -179.631 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.707 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-N19 108.586 0.983 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.707 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 117.153 1.846 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.689 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.579 2.223 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.621 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-N19 109.198 1.747 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.585 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.394 1.993 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.585 ' C5 ' H2'' ' E' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 N19-C1'-C2' 117.229 1.893 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.554 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 100.284 -1.956 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O3'-P-O5' 100.661 -1.757 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.644 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.535 2.169 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.644 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O3'-P-O5' 100.453 -1.867 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.556 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-N19 109.537 2.171 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.559 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O3'-P-O5' 99.721 -2.252 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.564 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O3'-P-O5' 99.993 -2.109 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.564 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.537 2.171 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.61 ' OP1' ' HA ' ' D' ' 19' ' ' PRO . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.988 2.735 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.611 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 O4'-C1'-N19 109.78 2.475 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.611 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 O4'-C1'-N19 109.956 2.695 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.564 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.17 0 O3'-P-O5' 99.64 -2.295 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.564 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.386 1.983 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.602 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.903 0 O3'-P-O5' 100.588 -1.796 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.602 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-N19 109.404 2.006 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.493 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 O4'-C1'-N19 109.76 2.45 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.53 H2'' ' C7 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.651 0 O4'-C1'-N19 109.514 2.143 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.53 ' C7 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O3'-P-O5' 100.746 -1.713 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.514 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.968 1.105 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.717 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C5'-C4'-O4' 108.221 -0.737 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.717 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 N19-C1'-C2' 117.113 1.82 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.521 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 110.042 2.802 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.809 0 O4'-C1'-N19 109.944 2.68 . . . . 4.55 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.45 H2'' ' C6 ' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.797 0 O3'-P-O5' 99.837 -2.191 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.45 ' C6 ' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-N19 109.681 2.351 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.51 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 O3'-P-O5' 99.471 -2.384 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.51 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.662 0 O3'-P-O5' 99.3 -2.474 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.654 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 100.094 -2.056 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.654 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-N19 110.147 2.933 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 99.482 -2.378 . . . . 3.72 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.877 0 O3'-P-O5' 99.809 -2.206 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.72 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.798 0 O3'-P-O5' 99.723 -2.251 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.72 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 O4'-C1'-N19 110.166 2.957 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.465 H2'' ' C6 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.645 0 O3'-P-O5' 99.251 -2.499 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.515 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.421 -0.782 0 O3'-P-O5' 99.682 -2.273 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.515 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O3'-P-O5' 99.432 -2.404 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.558 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.864 0 O3'-P-O5' 99.166 -2.544 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.618 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.418 -0.992 0 O3'-P-O5' 99.068 -2.596 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.682 H2'' ' C8 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.203 0 O3'-P-O5' 99.67 -2.279 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.682 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.2 0 O4'-C1'-N19 109.554 2.192 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.488 H2'' ' C6 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.826 0 O3'-P-O5' 100.02 -2.095 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.672 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.742 0 O3'-P-O5' 99.629 -2.3 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.672 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 101.552 -1.289 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . 0.431 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 116.391 1.369 . . . . 4.98 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.598 0.237 . . . . 9.79 111.132 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.48 166.79 13.12 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.281 -0.266 . . . . 10.89 110.281 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -91.7 6.91 44.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.823 0.344 . . . . 7.99 111.27 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.38 78.45 9.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.899 0.38 . . . . 5.88 111.259 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.57 57.53 1.84 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.625 -0.797 . . . . 3.69 111.978 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 5.18 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.64 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.86 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 3.36 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 3.49 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.402 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.44 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.79 110.941 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.91 110.68 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.4 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 4.19 112.014 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.507 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.75 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.95 112.172 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.73 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.93 112.421 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 4.13 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.31 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.424 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 4.1 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 3.29 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 4.15 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.55 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.96 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.81 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.53 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 5.43 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.43 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.49 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 3.39 111.174 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 3.37 109.846 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.51 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.87 110.629 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.558 ' HA ' ' O ' ' B' ' 4' ' ' THR . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.41 109.347 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.43 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.68 109.314 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.28 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.57 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 3.37 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.6 109.84 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.51 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.58 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.79 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.861 ' HZ2' ' HH ' ' A' ' 48' ' ' TYR . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.58 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.861 ' HH ' ' HZ2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.69 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.422 ' H ' ' HB2' ' A' ' 48' ' ' TYR . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 5.07 110.228 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.51 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 7.13 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.78 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 6.49 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -76.93 -33.47 57.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.57 110.222 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.448 ' NE2' ' HB2' ' C' ' 52' ' ' MET . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.71 -0.677 . . . . 7.28 109.728 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.911 0.386 . . . . 10.76 110.62 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -82.14 -21.23 36.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.373 0.606 . . . . 9.42 109.891 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 p -147.19 -79.13 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.336 -0.847 . . . . 6.91 109.183 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.558 ' O ' ' HA ' ' A' ' 37' ' ' TYR . 0.2 OUTLIER -121.99 -54.95 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.16 -0.473 . . . . 5.83 110.081 178.826 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 144.36 -82.1 0.21 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.507 -0.854 . . . . 4.11 112.297 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.85 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 4.04 110.868 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.88 109.662 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.62 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 4.11 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.52 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.89 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 4.23 109.846 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.75 114.105 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.513 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 4.22 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.507 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.5 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 3.46 110.841 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.401 ' CG2' ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.95 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . 0.401 ' HD2' ' CG2' ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.61 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.81 111.34 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.74 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' LEU . . . . . 0.402 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 4.02 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 4.46 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.53 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 5.09 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.85 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.435 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 5.35 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 4.09 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.49 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.89 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.56 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.96 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 2.71 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.95 110.042 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.12 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.79 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.65 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.8 110.813 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.74 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.38 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 4.18 110.554 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.439 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.86 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.82 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 3.18 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.95 108.33 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.67 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 4.11 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' TYR . . . . . 0.423 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.3 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.48 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 4.18 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.44 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp -132.36 -179.41 5.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.43 110.454 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.52 155.56 39.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.007 -0.542 . . . . 5.68 110.532 179.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.4 115.85 15.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.399 -0.364 . . . . 5.52 111.238 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 116.214 -0.448 . . . . 6.38 110.073 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.32 0.581 . . . . 8.0 110.168 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' LYS . . . . . 0.432 ' HG2' ' OG1' ' C' ' 4' ' ' THR . 44.1 tttm -167.05 100.15 0.53 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 9.03 109.535 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 46.96 0.35 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.579 0.585 . . . . 5.01 112.579 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' THR . . . . . 0.432 ' OG1' ' HG2' ' C' ' 2' ' ' LYS . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.42 109.763 179.229 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.54 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 4.61 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.98 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 4.0 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 3.28 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 3.27 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' ASP . . . . . 0.641 ' HB3' ' OP1' ' F' ' 7' ' ' ' DT' . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.57 108.671 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' GLU . . . . . 0.542 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . 0.405 ' HA ' ' HG3' ' D' ' 23' ' ' ARG . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.77 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' GLY . . . . . 0.411 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.24 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . 0.522 HH21 " C4'" ' F' ' 5' ' ' ' DT' . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.35 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' VAL . . . . . 0.526 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 3.02 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.81 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.72 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.71 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.88 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.24 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.94 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ARG . . . . . 0.495 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.63 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.48 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.57 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.35 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.77 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 4.15 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' GLU . . . . . 0.495 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.58 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.64 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.82 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.49 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 3.25 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' GLU . . . . . 0.541 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.44 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.73 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.74 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . 0.422 HG12 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 3.02 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.14 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 3.32 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 43' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.88 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.59 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.92 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.51 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 3.37 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 48' ' ' TYR . . . . . 0.541 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.26 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.71 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 4.02 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 52' ' ' MET . . . . . 0.448 ' HB2' ' NE2' ' A' ' 55' ' ' GLN . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.32 110.189 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 53' ' ' THR . . . . . 0.417 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 6.01 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 54' ' ' CYS . . . . . 0.417 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.12 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.7 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 1' ' ' MET . . . . . 0.421 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 4.11 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.96 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 3' ' ' SER . . . . . 0.422 ' CB ' HG12 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.94 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.69 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.92 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.73 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 7' ' ' VAL . . . . . 0.536 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.99 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 8' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.87 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 9' ' ' LYS . . . . . 0.447 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.65 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 10' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.19 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 11' ' ' ASP . . . . . 0.402 ' HB2' ' OP1' ' F' ' 5' ' ' ' DT' . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.59 109.93 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 12' ' ' GLU . . . . . 0.407 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.06 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 13' ' ' LEU . . . . . 0.416 ' HG ' H5'' ' E' ' 25' ' ' ' DT' . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 5.29 109.6 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.46 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' C' ' 15' ' ' ARG . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.93 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 16' ' ' VAL . . . . . 0.526 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 3.11 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 17' ' ' VAL . . . . . 0.434 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.93 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 18' ' ' ILE . . . . . 0.411 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.31 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 19' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.77 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 20' ' ' ILE . . . . . 0.478 ' O ' ' HG3' ' D' ' 24' ' ' ARG . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 5.14 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.98 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 22' ' ' LEU . . . . . 0.439 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.75 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 23' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' C' ' 13' ' ' LEU . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 3.33 111.682 -179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 24' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.55 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 4.2 110.296 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 3.28 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 3.04 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.35 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.81 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 30' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.4 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 4.0 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.66 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.51 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.53 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.34 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.73 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.24 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.19 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 39' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 2.0 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.76 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.75 111.382 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 42' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.68 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 2.45 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.35 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 45' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' C' ' 43' ' ' ILE . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 3.29 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.63 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 3.5 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.39 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 49' ' ' LYS . . . . . 0.435 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.45 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 50' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.95 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.7 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.43 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 6.55 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 5.0 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.62 110.197 -179.019 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 1' ' ' ' DA' . . . . . 0.658 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.25 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 2' ' ' ' DT' . . . . . 0.658 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 117.089 1.806 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 3' ' ' ' DG' . . . . . 0.752 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 100.788 -1.691 . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 4' ' ' ' DA' . . . . . 0.752 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.05 0 O4'-C1'-N19 109.603 2.254 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 5' ' ' ' DT' . . . . . 0.551 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.208 1.76 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 6' ' ' ' DT' . . . . . 0.682 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O3'-P-O5' 100.422 -1.883 . . . . 4.28 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 7' ' ' ' DG' . . . . . 0.682 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 109.458 2.073 . . . . 4.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 8' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 O4'-C1'-N19 109.161 1.702 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 9' ' ' ' DC' . . . . . 0.653 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.468 0 O4'-C1'-N19 109.455 2.068 . . . . 3.78 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 10' ' ' ' DA' . . . . . 0.714 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.812 -1.678 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 11' ' ' ' DA' . . . . . 0.714 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C1'-N19 109.7 2.375 . . . . 3.3 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 12' ' ' ' DT' . . . . . 0.515 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.595 2.244 . . . . 3.34 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 13' ' ' ' DT' . . . . . 0.515 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 109.552 2.19 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 14' ' ' ' DA' . . . . . 0.462 H2'' ' C6 ' ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-N19 109.499 2.124 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.462 ' C6 ' H2'' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.653 0 O4'-C1'-N19 109.642 2.303 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 16' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O3'-P-O5' 99.832 -2.194 . . . . 3.7 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.53 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 109.642 2.302 . . . . 3.84 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.57 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O3'-P-O5' 100.211 -1.994 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 19' ' ' ' DA' . . . . . 0.57 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.503 0 O4'-C1'-N19 109.38 1.975 . . . . 4.19 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 20' ' ' ' DA' . . . . . 0.644 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-N19 109.233 1.791 . . . . 4.31 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.644 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 109.497 2.121 . . . . 4.45 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 22' ' ' ' DC' . . . . . 0.491 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.653 2.316 . . . . 4.62 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 23' ' ' ' DC' . . . . . 0.528 H2'' ' C7 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.604 0 O4'-C1'-N19 109.664 2.329 . . . . 4.67 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 24' ' ' ' DT' . . . . . 0.528 ' C7 ' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.659 0 O3'-P-O5' 100.46 -1.863 . . . . 4.85 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 25' ' ' ' DT' . . . . . 0.449 ' C7 ' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 N19-C1'-C2' 116.142 1.214 . . . . 4.84 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 1' ' ' ' DA' . . . . . 0.701 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C5'-C4'-O4' 108.092 -0.817 . . . . 5.29 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 2' ' ' ' DA' . . . . . 0.701 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.893 0 N19-C1'-C2' 116.965 1.728 . . . . 5.28 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 3' ' ' ' DG' . . . . . 0.483 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.788 0 O4'-C1'-N19 109.869 2.586 . . . . 4.9 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.071 2.839 . . . . 4.55 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' F' F ' 5' ' ' ' DT' . . . . . 0.522 " C4'" HH21 ' C' ' 15' ' ' ARG . . . . . . . . 0 P--O3' 1.598 -0.72 0 O3'-P-O5' 99.352 -2.446 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 6' ' ' ' DT' . . . . . 0.521 ' C7 ' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O4'-C1'-N19 110.213 3.017 . . . . 4.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 7' ' ' ' DT' . . . . . 0.641 ' OP1' ' HB3' ' C' ' 11' ' ' ASP . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O3'-P-O5' 99.331 -2.458 . . . . 4.01 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 8' ' ' ' DC' . . . . . 0.506 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.153 -2.551 . . . . 4.02 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 9' ' ' ' DC' . . . . . 0.56 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O3'-P-O5' 99.506 -2.366 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 10' ' ' ' DA' . . . . . 0.56 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 109.54 2.175 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 11' ' ' ' DA' . . . . . 0.481 H2'' ' C7 ' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O3'-P-O5' 99.554 -2.34 . . . . 3.72 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 12' ' ' ' DT' . . . . . 0.481 ' C7 ' H2'' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 110.056 2.82 . . . . 3.8 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 13' ' ' ' DA' . . . . . 0.667 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.834 0 O3'-P-O5' 99.4 -2.421 . . . . 3.86 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 14' ' ' ' DA' . . . . . 0.667 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.118 0 O4'-C1'-N19 110.236 3.045 . . . . 3.81 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 15' ' ' ' DT' . . . . . 0.6 H2'' ' C5 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.191 0 O3'-P-O5' 98.987 -2.639 . . . . 3.87 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 16' ' ' ' DT' . . . . . 0.604 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.593 -1.162 0 O3'-P-O5' 99.569 -2.332 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 17' ' ' ' DG' . . . . . 0.604 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O4'-C1'-N19 109.899 2.624 . . . . 3.58 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 18' ' ' ' DT' . . . . . 0.473 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.594 -1.084 0 O3'-P-O5' 98.892 -2.688 . . . . 3.62 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 19' ' ' ' DC' . . . . . 0.821 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.592 -1.28 0 O3'-P-O5' 99.761 -2.231 . . . . 3.45 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 20' ' ' ' DA' . . . . . 0.821 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.866 0 O4'-C1'-N19 109.487 2.108 . . . . 3.42 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 21' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 O4'-C1'-N19 109.669 2.336 . . . . 3.85 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 22' ' ' ' DT' . . . . . 0.708 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O3'-P-O5' 100.012 -2.099 . . . . 4.22 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 23' ' ' ' DC' . . . . . 0.708 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 N19-C1'-C2' 117.447 2.03 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 24' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.829 0 O3'-P-O5' 101.224 -1.461 . . . . 4.76 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.712 0 N19-C1'-C2' 116.414 1.384 . . . . 4.98 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 111.901 -0.48 . . . . 3.5699999999999998 111.901 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 4.6799999999999997 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.27 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.4500000000000002 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 2.8900000000000001 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 2.9399999999999999 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.4400000000000004 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.6099999999999999 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.3499999999999996 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.0899999999999999 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 3.6099999999999999 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.3300000000000001 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.53 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.4100000000000001 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.1499999999999999 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HG2' HG21 ' B' ' 36' ' ' ILE . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.71 113.449 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 3.73 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.3099999999999996 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.452 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 3.5800000000000001 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.543 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 2.9500000000000002 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 3.8700000000000001 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.43 HG23 ' HG3' ' D' ' 2' ' ' LYS . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.0899999999999999 111.035 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.4900000000000002 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.7400000000000002 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.1100000000000003 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 4.9900000000000002 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.1699999999999999 111.671 -178.569 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.1200000000000001 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.527 ' O ' HG22 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 2.9500000000000002 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 2.9500000000000002 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' B' ' 8' ' ' ARG . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.75 110.002 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.1299999999999999 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.1800000000000002 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.6800000000000002 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.2800000000000002 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.1699999999999999 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 2.9100000000000001 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.2599999999999998 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.1000000000000001 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.562 HD22 HD11 ' B' ' 45' ' ' LEU . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.4399999999999999 110.175 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.3899999999999997 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 50' ' ' PRO . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.1399999999999997 108.969 178.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.4199999999999999 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 4.54 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.406 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.0199999999999996 112.329 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 6.6799999999999997 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.4699999999999998 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 5.7699999999999996 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.5499999999999998 110.424 179.735 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.463 -0.655 . . . . 4.1100000000000003 111.463 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ILE . . . . . 0.676 HG23 ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.25 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.676 ' H ' HG23 ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 3.3199999999999998 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.4699999999999998 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.3999999999999999 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 3.48 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.5199999999999996 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.8899999999999997 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 13' ' ' LEU . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 3.8199999999999998 110.376 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLY . . . . . 0.543 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.7000000000000002 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 3.7799999999999998 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.45 HG11 HD21 ' A' ' 45' ' ' LEU . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.0 108.096 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 2.9100000000000001 112.247 -178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.4399999999999999 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.5699999999999998 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ILE . . . . . 0.484 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.2800000000000002 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.7400000000000002 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 3.6499999999999999 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 3.98 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 4.7999999999999998 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.4100000000000001 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 4.8499999999999996 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 3.6899999999999999 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.0099999999999998 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.4299999999999997 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.5599999999999996 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.4699999999999998 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.3999999999999999 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.0 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.542 HG21 ' HG2' ' A' ' 19' ' ' PRO . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.5 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.489 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.3899999999999997 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.6000000000000001 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.7400000000000002 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.3799999999999999 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.407 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 3.7599999999999998 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.3499999999999996 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.4199999999999999 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 2.6899999999999999 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.562 HD11 HD22 ' A' ' 45' ' ' LEU . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.3599999999999999 110.715 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.426 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.21 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.426 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 3.6600000000000001 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.2000000000000002 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.0999999999999996 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 3.8100000000000001 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.2000000000000002 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.1900000000000004 110.329 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 3' ' ' SER . . . . . 0.424 ' HB2' ' HB3' ' C' ' 19' ' ' PRO . 1.8 m . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.069 -0.715 . . . . 5.0099999999999998 109.069 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 4' ' ' THR . . . . . 0.54 HG23 HG12 ' D' ' 38' ' ' VAL . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.25 110.354 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.4700000000000002 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 3.96 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.5299999999999998 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 3.6000000000000001 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 2.6400000000000001 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 2.7000000000000002 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.5699999999999998 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.3900000000000001 111.037 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.1600000000000001 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.55 HH11 HG22 ' D' ' 17' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.0499999999999998 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 2.6400000000000001 111.86 -178.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.4399999999999999 111.362 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.3399999999999999 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 19' ' ' PRO . . . . . 0.424 ' HB3' ' HB2' ' C' ' 3' ' ' SER . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.6600000000000001 112.579 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.46 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 21' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.1799999999999997 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.5299999999999998 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' C' ' 26' ' ' LEU . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.2199999999999998 110.805 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.04 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.0199999999999996 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.0800000000000001 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.4699999999999998 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 3.6899999999999999 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 30' ' ' GLU . . . . . 0.453 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.5800000000000001 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.1399999999999997 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 32' ' ' ASP . . . . . 0.468 ' O ' HG23 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.8199999999999998 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 33' ' ' ALA . . . . . 0.524 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.2599999999999998 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 2.6600000000000001 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.25 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.2400000000000002 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.522 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.3999999999999999 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 38' ' ' VAL . . . . . 0.535 HG13 ' HB2' ' D' ' 3' ' ' SER . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 2.5499999999999998 112.627 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.1400000000000001 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 2.96 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.3199999999999998 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.27 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.4399999999999999 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.02 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 2.96 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.2000000000000002 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.2400000000000002 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 3.7200000000000002 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 52' ' ' MET . . . . . 0.403 ' HB3' ' HB3' ' C' ' 55' ' ' GLN . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.0099999999999998 110.007 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 5.6200000000000001 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.1200000000000001 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 55' ' ' GLN . . . . . 0.403 ' HB3' ' HB3' ' C' ' 52' ' ' MET . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.3099999999999996 110.492 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 3.6899999999999999 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 2' ' ' LYS . . . . . 0.43 ' HG3' HG23 ' A' ' 25' ' ' THR . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.5699999999999998 110.509 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.535 ' HB2' HG13 ' C' ' 38' ' ' VAL . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.6400000000000001 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.4399999999999999 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.9199999999999999 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.4500000000000002 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.6099999999999999 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.77 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.1499999999999999 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.571 HG12 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.0800000000000001 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.5899999999999999 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.0599999999999996 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.469 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 4.8399999999999999 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.4300000000000002 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.571 ' H ' HG12 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.5099999999999998 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 2.75 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.55 HG22 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.3599999999999999 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.0800000000000001 109.778 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.46 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 20' ' ' ILE . . . . . 0.494 ' H ' HD12 ' D' ' 20' ' ' ILE . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 4.8200000000000003 111.523 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 21' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.9800000000000004 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.25 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 2.8799999999999999 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.0999999999999996 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 3.73 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 2.9700000000000002 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 2.79 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.1499999999999999 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.46 110.369 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.3999999999999999 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 3.4399999999999999 109.151 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.6600000000000001 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.2999999999999998 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.1099999999999999 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.3399999999999999 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.3300000000000001 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.2400000000000002 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 38' ' ' VAL . . . . . 0.54 HG12 HG23 ' C' ' 4' ' ' THR . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.1400000000000001 110.777 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.478 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 1.99 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 40' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.7599999999999998 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.3500000000000001 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.3399999999999999 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 43' ' ' ILE . . . . . 0.496 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 1.99 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.0 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 2.77 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.3599999999999999 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 2.9900000000000002 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.483 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.2599999999999998 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.0300000000000002 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 50' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.73 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.6200000000000001 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.29 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 5.8300000000000001 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 4.5199999999999996 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.0 110.11 -179.723 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.5699999999999998 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 4.6799999999999997 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.27 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.4500000000000002 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 2.8900000000000001 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 2.9399999999999999 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.717 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.4400000000000004 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.6099999999999999 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.534 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.3499999999999996 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.0899999999999999 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 3.6099999999999999 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.69 HG21 HG23 ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.3300000000000001 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.4100000000000001 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.1499999999999999 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.71 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 3.73 109.848 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.3099999999999996 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 3.5800000000000001 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 2.9500000000000002 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 3.8700000000000001 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.0899999999999999 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.4900000000000002 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.7400000000000002 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.1100000000000003 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 4.9900000000000002 111.279 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.433 ' O ' HG21 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.1699999999999999 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.1200000000000001 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 2.9500000000000002 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 2.9500000000000002 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.513 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.5099999999999998 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.75 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.1299999999999999 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.406 HG12 HG22 ' A' ' 43' ' ' ILE . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.1800000000000002 110.651 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.6800000000000002 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.2800000000000002 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.1699999999999999 110.495 179.277 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 2.9100000000000001 110.137 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.406 HG22 HG12 ' A' ' 38' ' ' VAL . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.2599999999999998 110.568 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.1000000000000001 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.4399999999999999 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.3899999999999997 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.1399999999999997 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.4199999999999999 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HA ' ' HD2' ' A' ' 50' ' ' PRO . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 4.54 109.798 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HB2' ' A' ' 29' ' ' ALA . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.0199999999999996 112.784 -178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 6.6799999999999997 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.4699999999999998 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 5.7699999999999996 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.5499999999999998 110.939 -179.898 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.1100000000000003 111.211 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.25 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 3.3199999999999998 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.4699999999999998 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.3999999999999999 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.578 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 3.48 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.5199999999999996 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.507 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.8899999999999997 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 3.8199999999999998 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.7000000000000002 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.437 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 3.7799999999999998 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.578 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.0 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 2.9100000000000001 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.69 HG23 HG21 ' A' ' 16' ' ' VAL . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.4399999999999999 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.5699999999999998 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.2800000000000002 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.7400000000000002 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' B' ' 22' ' ' LEU . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 3.6499999999999999 110.483 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 3.98 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 4.7999999999999998 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.4100000000000001 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 4.8499999999999996 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 3.6899999999999999 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.0099999999999998 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.4299999999999997 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.5599999999999996 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.4699999999999998 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 1.98 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.3999999999999999 110.456 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.5 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.405 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.3899999999999997 109.404 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.6000000000000001 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.7400000000000002 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.3799999999999999 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 3.7599999999999998 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.3499999999999996 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.4199999999999999 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 2.6899999999999999 111.014 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.3599999999999999 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.21 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 3.6600000000000001 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.2000000000000002 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.0999999999999996 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 3.8100000000000001 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.2000000000000002 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.1900000000000004 110.254 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.345 0.593 . . . . 5.0099999999999998 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.25 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.4700000000000002 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 3.96 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.5299999999999998 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 3.6000000000000001 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 9' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 2.6400000000000001 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.557 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 2.7000000000000002 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 11' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.5699999999999998 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 13' ' ' LEU . . . . . 0.49 HD22 ' HA ' ' C' ' 13' ' ' LEU . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.3900000000000001 110.064 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.1600000000000001 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.569 ' NE ' HG22 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.0499999999999998 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.411 ' H ' HG13 ' D' ' 16' ' ' VAL . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 2.6400000000000001 110.906 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 17' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.4399999999999999 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 18' ' ' ILE . . . . . 0.408 HG23 ' NE ' ' C' ' 23' ' ' ARG . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.3399999999999999 109.329 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.6600000000000001 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.46 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 21' ' ' GLU . . . . . 0.404 ' HB2' ' NH1' ' C' ' 24' ' ' ARG . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.1799999999999997 110.648 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.428 HD21 ' HB ' ' D' ' 38' ' ' VAL . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.5299999999999998 110.229 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 23' ' ' ARG . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.2199999999999998 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 24' ' ' ARG . . . . . 0.404 ' NH1' ' HB2' ' C' ' 21' ' ' GLU . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.04 108.982 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.0199999999999996 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.0800000000000001 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 28' ' ' ILE . . . . . 0.443 HD13 ' HG2' ' D' ' 41' ' ' GLU . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.4699999999999998 111.829 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 3.6899999999999999 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 30' ' ' GLU . . . . . 0.44 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.5800000000000001 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.1399999999999997 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.8199999999999998 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.2599999999999998 109.712 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.518 HD23 HG22 ' D' ' 10' ' ' VAL . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 2.6600000000000001 111.192 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.46 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.25 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' D' ' 8' ' ' ARG . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.2400000000000002 110.779 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.3999999999999999 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 2.5499999999999998 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 39' ' ' ASP . . . . . 0.441 ' CB ' HD13 ' C' ' 44' ' ' ILE . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.1400000000000001 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 2.96 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.3199999999999998 109.863 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 44' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' C' ' 39' ' ' ASP . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.27 110.794 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.503 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.4399999999999999 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.02 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 2.96 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.2400000000000002 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 3.7200000000000002 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.0099999999999998 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 5.6200000000000001 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.1200000000000001 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.3099999999999996 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 3.6899999999999999 110.503 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.5699999999999998 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.6400000000000001 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.4399999999999999 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.9199999999999999 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.4500000000000002 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.6099999999999999 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.58 ' HB2' HD11 ' C' ' 36' ' ' ILE . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.77 109.101 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.1499999999999999 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.518 HG22 HD23 ' C' ' 34' ' ' LEU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.0800000000000001 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.5899999999999999 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.0599999999999996 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 4.8399999999999999 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.4300000000000002 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.5099999999999998 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 2.75 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.569 HG22 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.3599999999999999 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.0800000000000001 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.46 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 20' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 4.8200000000000003 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' D' ' 24' ' ' ARG . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.9800000000000004 109.904 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.25 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 23' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 2.8799999999999999 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 24' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' D' ' 21' ' ' GLU . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.0999999999999996 110.019 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 3.73 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 2.9700000000000002 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 2.79 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.1499999999999999 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.46 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.663 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.3999999999999999 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 3.4399999999999999 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 32' ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.6600000000000001 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.2999999999999998 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.1099999999999999 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.3399999999999999 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.3300000000000001 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 37' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.2400000000000002 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 38' ' ' VAL . . . . . 0.428 ' HB ' HD21 ' C' ' 22' ' ' LEU . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.1400000000000001 111.042 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 1.99 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.7599999999999998 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 41' ' ' GLU . . . . . 0.443 ' HG2' HD13 ' C' ' 28' ' ' ILE . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.3500000000000001 110.919 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.3399999999999999 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 43' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 1.99 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 44' ' ' ILE . . . . . 0.471 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.0 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 2.77 110.181 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.3599999999999999 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 47' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 2.9900000000000002 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.452 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.2599999999999998 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.0300000000000002 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.73 111.946 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.6200000000000001 110.187 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.29 110.25 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 5.8300000000000001 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 4.5199999999999996 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.0 110.152 -179.764 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.783 0 N-CA-C 112.291 -0.324 . . . . 3.5699999999999998 112.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 4.6799999999999997 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.27 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.4500000000000002 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 2.8900000000000001 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 2.9399999999999999 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.4400000000000004 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.6099999999999999 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.414 ' H ' ' C ' ' A' ' 11' ' ' ASP . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.3499999999999996 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.0899999999999999 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 3.6099999999999999 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.3300000000000001 110.776 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.4100000000000001 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.1499999999999999 111.077 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.71 112.608 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 3.73 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.3099999999999996 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 3.5800000000000001 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 2.9500000000000002 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 3.8700000000000001 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.0899999999999999 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.4900000000000002 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.7400000000000002 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.1100000000000003 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 4.9900000000000002 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.1699999999999999 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.572 ' HA ' HG11 ' B' ' 10' ' ' VAL . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.1200000000000001 111.341 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 2.9500000000000002 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 2.9500000000000002 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 7' ' ' VAL . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.5099999999999998 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.75 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.535 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.1299999999999999 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.1800000000000002 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.535 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.6800000000000002 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.2800000000000002 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.1699999999999999 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 2.9100000000000001 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.2599999999999998 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.1000000000000001 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.4399999999999999 110.264 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.3899999999999997 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.1399999999999997 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.4199999999999999 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 4.54 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.0199999999999996 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 6.6799999999999997 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.4699999999999998 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 5.7699999999999996 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.5499999999999998 110.168 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 111.99 -0.444 . . . . 4.1100000000000003 111.99 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.25 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.611 HG22 ' HG2' ' A' ' 35' ' ' GLU . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 3.3199999999999998 110.153 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.4699999999999998 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.3999999999999999 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 31' ' ' LYS . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 3.48 112.093 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.5199999999999996 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.8899999999999997 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.464 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 3.8199999999999998 110.251 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.7000000000000002 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 3.7799999999999998 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.0 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.528 HG12 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 2.9100000000000001 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.528 ' H ' HG12 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.4399999999999999 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' PRO . . . . . 0.457 ' HD2' HG13 ' B' ' 18' ' ' ILE . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.5699999999999998 113.97 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.2800000000000002 111.535 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.7400000000000002 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' B' ' 26' ' ' LEU . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 3.6499999999999999 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 3.98 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 4.7999999999999998 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.4100000000000001 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 4.8499999999999996 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 3.6899999999999999 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.0099999999999998 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.4299999999999997 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.5599999999999996 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.4699999999999998 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 1.98 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.415 HD13 HD23 ' B' ' 45' ' ' LEU . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.3999999999999999 110.335 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.0 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.5 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.3899999999999997 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.6000000000000001 109.678 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.7400000000000002 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.3799999999999999 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 3.7599999999999998 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.3499999999999996 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.4199999999999999 111.688 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 2.6899999999999999 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.415 HD23 HD13 ' B' ' 34' ' ' LEU . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.3599999999999999 110.962 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.21 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 3.6600000000000001 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.2000000000000002 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.478 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.0999999999999996 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 3.8100000000000001 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.2000000000000002 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.1900000000000004 111.219 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.682 0.277 . . . . 5.0099999999999998 111.563 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.25 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.4700000000000002 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 6' ' ' ILE . . . . . 0.426 ' H ' HG13 ' C' ' 6' ' ' ILE . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 3.96 110.11 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.5299999999999998 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 3.6000000000000001 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 2.6400000000000001 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.419 HG22 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 2.7000000000000002 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.5699999999999998 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.3900000000000001 109.973 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 14' ' ' GLY . . . . . 0.438 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.1600000000000001 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.66 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.0499999999999998 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.482 HG21 HD12 ' D' ' 34' ' ' LEU . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 2.6400000000000001 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.4399999999999999 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 18' ' ' ILE . . . . . 0.44 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.3399999999999999 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.6600000000000001 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.46 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.1799999999999997 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.5299999999999998 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.461 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.2199999999999998 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.04 109.638 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.0199999999999996 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 27' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.0800000000000001 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 28' ' ' ILE . . . . . 0.474 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.4699999999999998 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 3.6899999999999999 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.5800000000000001 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 31' ' ' LYS . . . . . 0.575 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.1399999999999997 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 32' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.8199999999999998 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.2599999999999998 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 2.6600000000000001 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.25 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.2400000000000002 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' D' ' 3' ' ' SER . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.3999999999999999 109.017 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 2.5499999999999998 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.1400000000000001 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 2.96 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.3199999999999998 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.27 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.436 HD23 HD13 ' C' ' 34' ' ' LEU . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.4399999999999999 109.861 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.02 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 47' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' C' ' 47' ' ' LYS . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 2.96 109.352 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.2000000000000002 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.2400000000000002 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 3.7200000000000002 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.0099999999999998 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 5.6200000000000001 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.1200000000000001 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.3099999999999996 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 3.6899999999999999 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 2' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' D' ' 6' ' ' ILE . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.5699999999999998 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.6400000000000001 111.957 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.4399999999999999 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.9199999999999999 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 6' ' ' ILE . . . . . 0.423 HD12 ' HB2' ' D' ' 2' ' ' LYS . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.4500000000000002 110.102 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.6099999999999999 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.77 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.1499999999999999 112.009 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.0800000000000001 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.575 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.5899999999999999 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.0599999999999996 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 4.8399999999999999 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.4300000000000002 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.534 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.5099999999999998 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 2.75 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.3599999999999999 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.0800000000000001 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.46 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 4.8200000000000003 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.9800000000000004 111.225 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.25 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 23' ' ' ARG . . . . . 0.438 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 2.8799999999999999 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.0999999999999996 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 3.73 110.466 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 2.9700000000000002 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 2.79 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 28' ' ' ILE . . . . . 0.401 HG22 ' HE1' ' D' ' 48' ' ' TYR . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.1499999999999999 110.436 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.46 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.569 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.3999999999999999 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 3.4399999999999999 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.6600000000000001 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.523 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.1099999999999999 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.3399999999999999 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.3300000000000001 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 37' ' ' TYR . . . . . 0.452 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.2400000000000002 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.1400000000000001 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 1.99 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.7599999999999998 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.3500000000000001 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.3399999999999999 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 1.99 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 44' ' ' ILE . . . . . 0.452 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.0 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 2.77 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.3599999999999999 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 2.9900000000000002 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.418 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.2599999999999998 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.0300000000000002 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 50' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.73 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.6200000000000001 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 52' ' ' MET . . . . . 0.439 ' HG3' ' H ' ' D' ' 54' ' ' CYS . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.29 110.462 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 5.8300000000000001 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 54' ' ' CYS . . . . . 0.439 ' H ' ' HG3' ' D' ' 52' ' ' MET . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 4.5199999999999996 111.373 -179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.0 111.873 178.394 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.542 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.614 -0.595 . . . . 3.5699999999999998 111.614 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 4.6799999999999997 109.696 -178.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.446 ' CG1' ' HB1' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.27 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.4500000000000002 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 2.8900000000000001 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.558 HG21 HD12 ' B' ' 34' ' ' LEU . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 2.9399999999999999 110.452 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.4400000000000004 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.6099999999999999 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.3499999999999996 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.0899999999999999 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 3.6099999999999999 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.3300000000000001 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.433 ' HA ' ' HA ' ' B' ' 15' ' ' ARG . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.4100000000000001 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.1499999999999999 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.447 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.71 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 3.73 111.212 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.3099999999999996 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 3.5800000000000001 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 2.9500000000000002 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 3.8700000000000001 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.0899999999999999 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 ' HD3' ' A' ' 47' ' ' LYS . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.4900000000000002 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.7400000000000002 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.1100000000000003 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 4.9900000000000002 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.1699999999999999 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.1200000000000001 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' HG23 ' B' ' 10' ' ' VAL . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 2.9500000000000002 110.352 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 2.9500000000000002 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HG2' HG12 ' B' ' 7' ' ' VAL . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.5099999999999998 110.634 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.493 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.75 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.525 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.1299999999999999 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.1800000000000002 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.6800000000000002 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.2800000000000002 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.1699999999999999 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 2.9100000000000001 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.2599999999999998 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.1000000000000001 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.512 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.4399999999999999 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.3899999999999997 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.603 ' HD3' HD11 ' A' ' 26' ' ' LEU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.1399999999999997 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.4199999999999999 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 4.54 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.0199999999999996 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 6.6799999999999997 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.4699999999999998 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 5.7699999999999996 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.5499999999999998 111.368 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLY . . . . . 0.525 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.41 -0.106 . . . . 4.1100000000000003 112.837 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.25 111.096 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' GLU . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 3.3199999999999998 110.233 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.4699999999999998 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.432 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.3999999999999999 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.463 HG23 ' HA ' ' A' ' 33' ' ' ALA . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 3.48 110.062 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.5199999999999996 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.8899999999999997 110.166 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 3.8199999999999998 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.7000000000000002 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 3.7799999999999998 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.0 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 2.9100000000000001 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.4399999999999999 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.5699999999999998 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.2800000000000002 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' B' ' 21' ' ' GLU . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.7400000000000002 109.685 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 3.6499999999999999 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 3.98 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 4.7999999999999998 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.4100000000000001 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 4.8499999999999996 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 3.6899999999999999 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.0099999999999998 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.4299999999999997 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.5599999999999996 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.4699999999999998 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.446 ' HB1' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 1.98 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.558 HD12 HG21 ' A' ' 10' ' ' VAL . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.3999999999999999 109.487 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.0 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.5 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.564 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.3899999999999997 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.542 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.6000000000000001 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.7400000000000002 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.3799999999999999 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.446 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 3.7599999999999998 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.3499999999999996 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.4199999999999999 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.564 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 2.6899999999999999 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.3599999999999999 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.21 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 3.6600000000000001 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.2000000000000002 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 3.8100000000000001 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.2000000000000002 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.1900000000000004 110.621 179.749 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 3' ' ' SER . . . . . 0.41 ' OG ' HD11 ' C' ' 22' ' ' LEU . 19.3 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.318 0.58 . . . . 5.0099999999999998 110.883 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.25 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.4700000000000002 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 3.96 110.748 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.414 HG22 ' H ' ' C' ' 7' ' ' VAL . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.5299999999999998 110.486 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 3.6000000000000001 110.468 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 2.6400000000000001 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 2.7000000000000002 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.5699999999999998 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.3900000000000001 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.1600000000000001 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' OD2' ' D' ' 11' ' ' ASP . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.0499999999999998 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.483 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 2.6400000000000001 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 17' ' ' VAL . . . . . 0.407 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.4399999999999999 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.3399999999999999 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.6600000000000001 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.46 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.1799999999999997 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.41 HD11 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.5299999999999998 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.455 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.2199999999999998 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 24' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.04 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.0199999999999996 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.0800000000000001 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.4699999999999998 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 3.6899999999999999 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 30' ' ' GLU . . . . . 0.428 ' HB2' ' HE3' ' C' ' 31' ' ' LYS . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.5800000000000001 110.267 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 31' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' C' ' 30' ' ' GLU . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.1399999999999997 109.875 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.8199999999999998 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.2599999999999998 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 2.6600000000000001 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.25 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.2400000000000002 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.3999999999999999 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 2.5499999999999998 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.1400000000000001 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 2.96 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.3199999999999998 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 44' ' ' ILE . . . . . 0.584 HG22 HD13 ' D' ' 44' ' ' ILE . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.27 110.845 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.4399999999999999 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.02 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 2.96 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.2000000000000002 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.2400000000000002 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 3.7200000000000002 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.0099999999999998 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 5.6200000000000001 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.1200000000000001 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.3099999999999996 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 1' ' ' MET . . . . . 0.417 ' N ' ' HB2' ' A' ' 21' ' ' GLU . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 3.6899999999999999 110.236 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.5699999999999998 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.6400000000000001 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.4399999999999999 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 5' ' ' GLY . . . . . 0.491 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.9199999999999999 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.4500000000000002 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.6099999999999999 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.684 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.77 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.1499999999999999 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.0800000000000001 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.493 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.5899999999999999 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.0599999999999996 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 4.8399999999999999 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 14' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.4300000000000002 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.489 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.5099999999999998 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.483 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 2.75 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.684 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.3599999999999999 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.0800000000000001 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 19' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.46 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 4.8200000000000003 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.9800000000000004 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 22' ' ' LEU . . . . . 0.427 ' HA ' HD23 ' D' ' 22' ' ' LEU . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.25 110.228 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 23' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 2.8799999999999999 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.0999999999999996 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 3.73 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 2.9700000000000002 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 2.79 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.1499999999999999 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.46 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.475 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.3999999999999999 111.121 -179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 3.4399999999999999 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.6600000000000001 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 33' ' ' ALA . . . . . 0.58 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.2999999999999998 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.414 ' CD2' ' HA ' ' D' ' 47' ' ' LYS . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.1099999999999999 109.739 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.3399999999999999 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 36' ' ' ILE . . . . . 0.407 HG12 HD12 ' D' ' 45' ' ' LEU . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.3300000000000001 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 37' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.2400000000000002 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.1400000000000001 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 1.99 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.7599999999999998 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.3500000000000001 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.3399999999999999 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 1.99 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 44' ' ' ILE . . . . . 0.584 HD13 HG22 ' C' ' 44' ' ' ILE . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.0 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 45' ' ' LEU . . . . . 0.407 HD12 HG12 ' D' ' 36' ' ' ILE . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 2.77 110.836 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.459 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.3599999999999999 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 47' ' ' LYS . . . . . 0.414 ' HA ' ' CD2' ' D' ' 34' ' ' LEU . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 2.9900000000000002 110.498 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.2599999999999998 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.0300000000000002 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.73 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.6200000000000001 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.29 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 5.8300000000000001 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 4.5199999999999996 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.0 110.512 179.942 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 112.473 -0.251 . . . . 3.5699999999999998 112.473 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 4.6799999999999997 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG21 ' SD ' ' B' ' 52' ' ' MET . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.27 109.905 179.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.4500000000000002 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 2.8900000000000001 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 2.9399999999999999 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.4400000000000004 110.527 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.6099999999999999 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.3499999999999996 110.785 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.0899999999999999 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 3.6099999999999999 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.3300000000000001 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.4100000000000001 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.71 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 3.73 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.3099999999999996 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 3.5800000000000001 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 2.9500000000000002 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 3.8700000000000001 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.0899999999999999 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.4900000000000002 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.7400000000000002 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.1100000000000003 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 4.9900000000000002 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' O ' HG21 ' B' ' 10' ' ' VAL . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.1699999999999999 111.32 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.52 ' HA ' HG11 ' B' ' 10' ' ' VAL . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.1200000000000001 110.965 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 2.9500000000000002 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 2.9500000000000002 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HG2' HG22 ' B' ' 7' ' ' VAL . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.5099999999999998 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.75 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.1299999999999999 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.1800000000000002 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.6800000000000002 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.2800000000000002 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.1699999999999999 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 2.9100000000000001 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.2599999999999998 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.1000000000000001 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.417 HD21 HG11 ' B' ' 16' ' ' VAL . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.4399999999999999 111.058 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.3899999999999997 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.1399999999999997 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.4199999999999999 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 4.54 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.0199999999999996 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 6.6799999999999997 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.4699999999999998 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 5.7699999999999996 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.5499999999999998 110.102 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.25 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.646 HG22 ' HG2' ' A' ' 35' ' ' GLU . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 3.3199999999999998 109.699 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' B' ' 8' ' ' ARG . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.4699999999999998 110.952 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' B' ' 10' ' ' VAL . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.3999999999999999 110.673 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 31' ' ' LYS . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 3.48 111.361 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.5199999999999996 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.8899999999999997 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.476 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 3.8199999999999998 109.92 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.7000000000000002 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.471 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 3.7799999999999998 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.0 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.464 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 2.9100000000000001 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.4399999999999999 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.5699999999999998 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.2800000000000002 111.722 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.7400000000000002 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 3.6499999999999999 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 3.98 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 4.7999999999999998 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.4100000000000001 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.439 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 4.8499999999999996 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' GLY . . . . . 0.439 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 3.6899999999999999 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ILE . . . . . 0.486 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.0099999999999998 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.4299999999999997 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.5599999999999996 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.4699999999999998 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.486 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 1.98 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.3999999999999999 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.0 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.522 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.5 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.3899999999999997 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.6000000000000001 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.7400000000000002 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.3799999999999999 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 3.7599999999999998 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.3499999999999996 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.4199999999999999 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 2.6899999999999999 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.3599999999999999 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.21 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 3.6600000000000001 111.156 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.2000000000000002 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.0999999999999996 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 3.8100000000000001 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.2000000000000002 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' MET . . . . . 0.408 ' SD ' HG21 ' A' ' 7' ' ' VAL . 85.5 mmm . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.1900000000000004 110.384 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.617 0.246 . . . . 5.0099999999999998 111.606 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 4' ' ' THR . . . . . 0.446 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.25 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 3.96 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.5299999999999998 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 3.6000000000000001 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 2.6400000000000001 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.502 HG13 HG22 ' C' ' 16' ' ' VAL . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 2.7000000000000002 108.696 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.5699999999999998 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.3900000000000001 109.909 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.1600000000000001 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.419 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.0499999999999998 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.502 HG22 HG13 ' C' ' 10' ' ' VAL . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 2.6400000000000001 109.858 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.4399999999999999 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 18' ' ' ILE . . . . . 0.414 HG13 ' HD2' ' C' ' 19' ' ' PRO . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.3399999999999999 109.792 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 19' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' C' ' 18' ' ' ILE . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.6600000000000001 110.919 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.46 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.1799999999999997 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.5299999999999998 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.463 ' HD2' HD11 ' C' ' 28' ' ' ILE . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.2199999999999998 109.851 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.04 110.583 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.0199999999999996 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.0800000000000001 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 28' ' ' ILE . . . . . 0.463 HD11 ' HD2' ' C' ' 23' ' ' ARG . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.4699999999999998 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 3.6899999999999999 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.5800000000000001 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.1399999999999997 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 32' ' ' ASP . . . . . 0.512 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.8199999999999998 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.2599999999999998 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 2.6600000000000001 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.25 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.2400000000000002 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.3999999999999999 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 38' ' ' VAL . . . . . 0.475 HG13 ' CB ' ' D' ' 3' ' ' SER . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 2.5499999999999998 111.767 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.1400000000000001 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 2.96 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.3199999999999998 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.27 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.4399999999999999 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.02 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 2.96 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.2000000000000002 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.2400000000000002 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 3.7200000000000002 109.37 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.0099999999999998 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 5.6200000000000001 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.1200000000000001 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.3099999999999996 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 3.6899999999999999 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.5699999999999998 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.6400000000000001 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.4399999999999999 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.9199999999999999 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.4500000000000002 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.6099999999999999 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.567 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.77 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 9' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.1499999999999999 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.536 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.0800000000000001 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.5899999999999999 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.419 ' CD ' HH12 ' C' ' 15' ' ' ARG . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.0599999999999996 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 4.8399999999999999 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 14' ' ' GLY . . . . . 0.536 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.4300000000000002 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.5099999999999998 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 2.75 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.3599999999999999 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.0800000000000001 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.46 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 20' ' ' ILE . . . . . 0.451 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 4.8200000000000003 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 21' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.9800000000000004 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 22' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.25 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 2.8799999999999999 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.0999999999999996 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 3.73 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 2.9700000000000002 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 2.79 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 28' ' ' ILE . . . . . 0.432 HG22 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.1499999999999999 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.46 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.3999999999999999 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 3.4399999999999999 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.6600000000000001 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.2999999999999998 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.481 HD12 HG11 ' C' ' 16' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.1099999999999999 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.3399999999999999 108.302 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.3300000000000001 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 37' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.2400000000000002 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.1400000000000001 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 1.99 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.7599999999999998 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.3500000000000001 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.3399999999999999 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 1.99 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.0 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 2.77 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.3599999999999999 111.167 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 2.9900000000000002 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.432 ' CE1' HG22 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.2599999999999998 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.0300000000000002 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.73 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.6200000000000001 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.29 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 5.8300000000000001 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 4.5199999999999996 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.0 111.145 179.78 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 111.396 -0.681 . . . . 3.5699999999999998 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 4.6799999999999997 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.27 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.4500000000000002 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 2.9399999999999999 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.4400000000000004 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.693 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.6099999999999999 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.55 HD22 HH12 ' A' ' 15' ' ' ARG . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.3499999999999996 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.0899999999999999 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.55 HH12 HD22 ' A' ' 13' ' ' LEU . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 3.6099999999999999 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.3300000000000001 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.4100000000000001 110.182 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.1499999999999999 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.513 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.71 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.42 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 3.73 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.3099999999999996 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 3.5800000000000001 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 2.9500000000000002 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 3.8700000000000001 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.0899999999999999 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.4900000000000002 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.7400000000000002 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.1100000000000003 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 4.9900000000000002 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.1699999999999999 110.932 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.1200000000000001 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 2.9500000000000002 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' HG22 ' B' ' 10' ' ' VAL . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 2.9500000000000002 111.251 -179.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.5099999999999998 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.466 ' HB ' HG23 ' B' ' 6' ' ' ILE . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.75 110.322 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.1299999999999999 111.155 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.1800000000000002 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.6800000000000002 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.2800000000000002 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.1699999999999999 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 2.9100000000000001 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.2599999999999998 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.1000000000000001 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.407 HD11 ' HB3' ' A' ' 34' ' ' LEU . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.4399999999999999 109.253 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.3899999999999997 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.1399999999999997 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.4199999999999999 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 4.54 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.0199999999999996 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 6.6799999999999997 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.4699999999999998 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 5.7699999999999996 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.5499999999999998 109.997 179.224 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.795 0 N-CA-C 112.122 -0.391 . . . . 4.1100000000000003 112.122 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 6' ' ' ILE . . . . . 0.466 HG23 ' HB ' ' A' ' 36' ' ' ILE . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.25 110.204 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.552 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 3.3199999999999998 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.4699999999999998 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.3999999999999999 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.421 HG22 ' HG ' ' A' ' 34' ' ' LEU . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 3.48 110.093 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.5199999999999996 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.8899999999999997 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 3.8199999999999998 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLY . . . . . 0.475 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.7000000000000002 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.475 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 3.7799999999999998 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.0 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.451 HG12 ' HB3' ' A' ' 15' ' ' ARG . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 2.9100000000000001 111.618 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 43' ' ' ILE . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.4399999999999999 110.048 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.5699999999999998 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ILE . . . . . 0.439 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.2800000000000002 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.7400000000000002 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 3.6499999999999999 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.493 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 3.98 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.439 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 4.7999999999999998 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.4100000000000001 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 4.8499999999999996 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 3.6899999999999999 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.0099999999999998 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.4299999999999997 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.5599999999999996 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.4699999999999998 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.3999999999999999 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.0 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.423 HG22 ' HG ' ' B' ' 45' ' ' LEU . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.5 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.3899999999999997 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.6000000000000001 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.428 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.7400000000000002 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.3799999999999999 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 3.7599999999999998 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.3499999999999996 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.4199999999999999 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 2.6899999999999999 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.507 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.3599999999999999 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.21 110.866 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 3.6600000000000001 110.356 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.2000000000000002 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.0999999999999996 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 3.8100000000000001 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.2000000000000002 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.1900000000000004 110.881 -179.179 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 120.661 0.267 . . . . 5.0099999999999998 110.921 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.25 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.4700000000000002 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 3.96 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.5299999999999998 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 3.6000000000000001 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 2.6400000000000001 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 2.7000000000000002 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.5699999999999998 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 13' ' ' LEU . . . . . 0.582 HD21 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.3900000000000001 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.1600000000000001 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.0499999999999998 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 2.6400000000000001 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.4399999999999999 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.3399999999999999 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.6600000000000001 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.46 111.03 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.1799999999999997 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' C' ' 22' ' ' LEU . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.5299999999999998 111.433 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.524 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.2199999999999998 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.04 111.418 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.0199999999999996 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.0800000000000001 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.4699999999999998 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 3.6899999999999999 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.5800000000000001 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.1399999999999997 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.8199999999999998 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 33' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.2599999999999998 110.554 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 2.6600000000000001 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.25 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.2400000000000002 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.3999999999999999 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 2.5499999999999998 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 39' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.1400000000000001 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 42' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 2.96 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 43' ' ' ILE . . . . . 0.468 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.3199999999999998 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.27 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.4399999999999999 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.02 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 2.96 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.2000000000000002 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.2400000000000002 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 3.7200000000000002 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.0099999999999998 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 5.6200000000000001 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.1200000000000001 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.3099999999999996 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 3.6899999999999999 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.5699999999999998 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.41 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.6400000000000001 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.4399999999999999 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.9199999999999999 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.4500000000000002 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' HB1' ' C' ' 33' ' ' ALA . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.6099999999999999 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.77 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.1499999999999999 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.544 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.5899999999999999 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.0599999999999996 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.544 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 4.8399999999999999 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 14' ' ' GLY . . . . . 0.524 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.4300000000000002 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.582 HH11 HD21 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.5099999999999998 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.617 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 2.75 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.492 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.3599999999999999 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.0800000000000001 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.46 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 4.8200000000000003 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.9800000000000004 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 22' ' ' LEU . . . . . 0.41 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.25 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 23' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 2.8799999999999999 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.0999999999999996 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 3.73 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 2.9700000000000002 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 2.79 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 28' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.1499999999999999 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 29' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.46 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.3999999999999999 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 31' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 3.4399999999999999 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.6600000000000001 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.2999999999999998 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.478 ' HB3' HD11 ' D' ' 45' ' ' LEU . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1099999999999999 110.261 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.3399999999999999 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.3300000000000001 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.2400000000000002 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.1400000000000001 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.63 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.7599999999999998 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.3500000000000001 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.3399999999999999 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 1.99 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.0 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 45' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' D' ' 34' ' ' LEU . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 2.77 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.3599999999999999 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 2.9900000000000002 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.2599999999999998 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.0300000000000002 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.73 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.6200000000000001 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.29 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 5.8300000000000001 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 4.5199999999999996 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.0 110.041 -179.055 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 N-CA-C 112.362 -0.295 . . . . 3.5699999999999998 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 4.6799999999999997 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.27 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.4500000000000002 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 2.8900000000000001 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.409 HG22 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 2.9399999999999999 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.4400000000000004 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.6099999999999999 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.3499999999999996 111.499 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.0899999999999999 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.503 ' HG3' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 3.6099999999999999 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.603 HG13 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.3300000000000001 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.4100000000000001 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.1499999999999999 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.71 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 3.73 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.3099999999999996 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 3.5800000000000001 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 2.9500000000000002 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 3.8700000000000001 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.0899999999999999 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.4900000000000002 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.7400000000000002 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.1100000000000003 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 4.9900000000000002 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.1699999999999999 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' B' ' 10' ' ' VAL . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.1200000000000001 110.208 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 2.9500000000000002 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 2.9500000000000002 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.5099999999999998 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.75 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.1299999999999999 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.1800000000000002 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.6800000000000002 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.2800000000000002 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.512 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.1699999999999999 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.512 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 2.9100000000000001 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.437 ' HB ' ' HB3' ' B' ' 45' ' ' LEU . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.2599999999999998 108.807 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.433 HG22 ' HG3' ' A' ' 46' ' ' LYS . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.1000000000000001 111.33 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.4399999999999999 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 44' ' ' ILE . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.3899999999999997 109.872 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.1399999999999997 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.58 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.4199999999999999 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 4.54 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.0199999999999996 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 6.6799999999999997 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.4699999999999998 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.555 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 5.7699999999999996 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.5499999999999998 109.845 179.607 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.502 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.25 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 3.3199999999999998 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.4699999999999998 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.3999999999999999 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.424 HG21 ' HA ' ' A' ' 31' ' ' LYS . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 3.48 109.542 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.5199999999999996 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.8899999999999997 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 3.8199999999999998 109.802 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.7000000000000002 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 3.7799999999999998 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.0 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 15' ' ' ARG . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 2.9100000000000001 111.531 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.44 HG23 ' HD2' ' B' ' 19' ' ' PRO . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.4399999999999999 109.172 178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG23 ' B' ' 18' ' ' ILE . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.5699999999999998 113.109 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.2800000000000002 112.625 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.7400000000000002 111.872 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 3.6499999999999999 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.403 ' HA ' ' HA2' ' B' ' 27' ' ' GLY . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 3.98 111.146 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 4.7999999999999998 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.4100000000000001 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 4.8499999999999996 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' B' ' 23' ' ' ARG . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 3.6899999999999999 111.268 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ILE . . . . . 0.414 HD11 HG21 ' B' ' 18' ' ' ILE . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.0099999999999998 111.406 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.4299999999999997 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.5599999999999996 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.4699999999999998 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.409 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 1.98 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.3999999999999999 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.0 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.5 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.3899999999999997 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.6000000000000001 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.7400000000000002 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.3799999999999999 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 3.7599999999999998 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.3499999999999996 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.4199999999999999 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 2.6899999999999999 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' ILE . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.3599999999999999 109.787 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.21 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 3.6600000000000001 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.2000000000000002 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.0999999999999996 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 3.8100000000000001 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' B' ' 52' ' ' MET . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.2000000000000002 111.422 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' MET . . . . . 0.443 ' H ' ' HB3' ' B' ' 51' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.1900000000000004 110.289 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 3' ' ' SER . . . . . 0.512 ' HA ' HD11 ' C' ' 6' ' ' ILE . 4.2 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.414 0.626 . . . . 5.0099999999999998 110.038 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.25 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.4700000000000002 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 6' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' C' ' 3' ' ' SER . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 3.96 110.054 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.5299999999999998 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 3.6000000000000001 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 2.6400000000000001 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 2.7000000000000002 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.5699999999999998 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 13' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' C' ' 13' ' ' LEU . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.3900000000000001 110.95 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.1600000000000001 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.0499999999999998 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 2.6400000000000001 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 17' ' ' VAL . . . . . 0.776 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.4399999999999999 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 18' ' ' ILE . . . . . 0.46 ' H ' HD12 ' C' ' 18' ' ' ILE . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.3399999999999999 109.602 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.6600000000000001 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 20' ' ' ILE . . . . . 0.444 ' H ' HD12 ' C' ' 20' ' ' ILE . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.46 111.421 -179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.1799999999999997 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.62 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.5299999999999998 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' C' ' 23' ' ' ARG . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.2199999999999998 110.818 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.04 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.0199999999999996 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.0800000000000001 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.4699999999999998 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 3.6899999999999999 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.5800000000000001 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 31' ' ' LYS . . . . . 0.496 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.1399999999999997 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.8199999999999998 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 33' ' ' ALA . . . . . 0.543 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.2599999999999998 110.899 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 2.6600000000000001 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.689 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.25 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.2400000000000002 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.3999999999999999 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 2.5499999999999998 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 41' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.1400000000000001 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 2.96 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 43' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.3199999999999998 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.27 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.02 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 2.96 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.2000000000000002 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.2400000000000002 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 3.7200000000000002 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.0099999999999998 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 5.6200000000000001 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 54' ' ' CYS . . . . . 0.555 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.1200000000000001 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.3099999999999996 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 1' ' ' MET . . . . . 0.451 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 3.6899999999999999 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.5699999999999998 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.6400000000000001 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.4399999999999999 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.9199999999999999 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.4500000000000002 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.569 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.6099999999999999 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.451 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.77 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 9' ' ' LYS . . . . . 0.414 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.1499999999999999 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' C' ' 33' ' ' ALA . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.0800000000000001 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.602 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.5899999999999999 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.496 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.0599999999999996 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' D' ' 13' ' ' LEU . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 4.8399999999999999 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.4300000000000002 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.776 ' HA ' HG22 ' C' ' 17' ' ' VAL . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.5099999999999998 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 2.75 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.3599999999999999 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.0800000000000001 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.46 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 4.8200000000000003 110.522 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.9800000000000004 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.25 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 2.8799999999999999 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.0999999999999996 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 3.73 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 2.9700000000000002 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 2.79 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.1499999999999999 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.46 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.3999999999999999 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 3.4399999999999999 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.6600000000000001 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.2999999999999998 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.1099999999999999 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.3399999999999999 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.3300000000000001 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.2400000000000002 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.1400000000000001 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 1.99 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.7599999999999998 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.3500000000000001 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.3399999999999999 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 43' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 1.99 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 44' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.0 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 2.77 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.435 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.3599999999999999 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 2.9900000000000002 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.2599999999999998 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.0300000000000002 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.73 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.6200000000000001 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.29 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 5.8300000000000001 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 4.5199999999999996 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.0 109.564 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.5699999999999998 110.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 4.6799999999999997 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.27 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.4500000000000002 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 2.8900000000000001 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 2.9399999999999999 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.467 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.4400000000000004 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.6099999999999999 109.993 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.3499999999999996 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.0899999999999999 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 3.6099999999999999 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.721 HG22 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.3300000000000001 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.4100000000000001 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.1499999999999999 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.608 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.71 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 3.73 111.277 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.3099999999999996 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 3.5800000000000001 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 2.9500000000000002 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 3.8700000000000001 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.0899999999999999 111.141 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.4900000000000002 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.7400000000000002 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.1100000000000003 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 4.9900000000000002 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.1699999999999999 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.1200000000000001 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 2.9500000000000002 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 45' ' ' LEU . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 2.9500000000000002 110.671 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.5099999999999998 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.75 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.1299999999999999 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.1800000000000002 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.6800000000000002 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.2800000000000002 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.1699999999999999 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 2.9100000000000001 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.2599999999999998 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.1000000000000001 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.4399999999999999 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.3899999999999997 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.1399999999999997 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.4199999999999999 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 4.54 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.574 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.0199999999999996 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 6.6799999999999997 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.4699999999999998 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 5.7699999999999996 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t . . . . . 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.5499999999999998 111.216 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 111.345 -0.702 . . . . 4.1100000000000003 111.345 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 6' ' ' ILE . . . . . 0.476 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.25 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 3.3199999999999998 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.4699999999999998 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.3999999999999999 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 3.48 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.5199999999999996 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.8899999999999997 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 3.8199999999999998 110.363 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.7000000000000002 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 3.7799999999999998 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.0 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 2.9100000000000001 111.201 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.4399999999999999 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.5699999999999998 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.2800000000000002 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.7400000000000002 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 3.6499999999999999 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 3.98 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 4.7999999999999998 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.4100000000000001 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 4.8499999999999996 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 3.6899999999999999 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.0099999999999998 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.4299999999999997 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.5599999999999996 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.4699999999999998 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 1.98 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.3999999999999999 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.0 110.332 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.5 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.3899999999999997 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.601 HG22 HG23 ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.6000000000000001 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.7400000000000002 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.3799999999999999 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 3.7599999999999998 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.3499999999999996 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.601 HG23 HG22 ' B' ' 38' ' ' VAL . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.4199999999999999 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.659 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.3599999999999999 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.21 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 3.6600000000000001 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.2000000000000002 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.0999999999999996 110.438 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 3.8100000000000001 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.2000000000000002 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.1900000000000004 110.443 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 120.764 0.316 . . . . 5.0099999999999998 110.15 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.25 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.4700000000000002 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 3.96 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.5299999999999998 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 3.6000000000000001 110.104 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 9' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 2.6400000000000001 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 2.7000000000000002 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 11' ' ' ASP . . . . . 0.4 ' HB3' ' N ' ' C' ' 15' ' ' ARG . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.5699999999999998 109.178 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.3900000000000001 111.652 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.1600000000000001 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.0499999999999998 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 2.6400000000000001 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 17' ' ' VAL . . . . . 0.463 HG22 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.4399999999999999 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.3399999999999999 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 19' ' ' PRO . . . . . 0.548 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.6600000000000001 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 20' ' ' ILE . . . . . 0.441 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.46 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.1799999999999997 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.5299999999999998 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.2199999999999998 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 24' ' ' ARG . . . . . 0.441 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.04 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 25' ' ' THR . . . . . 0.413 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.0199999999999996 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.0800000000000001 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.4699999999999998 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 3.6899999999999999 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.5800000000000001 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 31' ' ' LYS . . . . . 0.483 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.1399999999999997 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.8199999999999998 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.2599999999999998 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 2.6600000000000001 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.507 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.25 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.2400000000000002 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.3999999999999999 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 38' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' C' ' 43' ' ' ILE . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 2.5499999999999998 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 40' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.1400000000000001 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 2.96 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 43' ' ' ILE . . . . . 0.556 ' HA ' HG12 ' C' ' 38' ' ' VAL . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.3199999999999998 109.801 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.27 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 45' ' ' LEU . . . . . 0.423 ' HB3' HD23 ' C' ' 34' ' ' LEU . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.4399999999999999 109.768 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 46' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.02 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 2.96 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.2000000000000002 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.2400000000000002 109.588 -179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 3.7200000000000002 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.0099999999999998 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 53' ' ' THR . . . . . 0.412 ' O ' ' HB3' ' C' ' 54' ' ' CYS . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 5.6200000000000001 110.034 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 54' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' C' ' 53' ' ' THR . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.1200000000000001 111.437 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.3099999999999996 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 3.6899999999999999 110.253 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.5699999999999998 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.494 ' O ' HG22 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.6400000000000001 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.4399999999999999 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.9199999999999999 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.4500000000000002 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.6099999999999999 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.77 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.1499999999999999 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.0800000000000001 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.5899999999999999 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.0599999999999996 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.512 ' HA ' HD13 ' D' ' 13' ' ' LEU . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 4.8399999999999999 111.386 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.4300000000000002 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.463 ' HE ' HG22 ' C' ' 17' ' ' VAL . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.5099999999999998 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 2.75 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.543 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.3599999999999999 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.0800000000000001 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.46 113.745 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 4.8200000000000003 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.9800000000000004 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 22' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.25 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 2.8799999999999999 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.0999999999999996 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 3.73 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 2.9700000000000002 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 2.79 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.1499999999999999 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.46 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.543 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.3999999999999999 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 3.4399999999999999 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 32' ' ' ASP . . . . . 0.44 ' O ' HG23 ' C' ' 10' ' ' VAL . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.6600000000000001 110.509 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 33' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.2999999999999998 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.1099999999999999 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 35' ' ' GLU . . . . . 0.438 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.3399999999999999 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.3300000000000001 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.2400000000000002 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 38' ' ' VAL . . . . . 0.41 ' HB ' HD21 ' C' ' 22' ' ' LEU . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.1400000000000001 110.637 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.631 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 1.99 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.7599999999999998 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.3500000000000001 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.3399999999999999 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 1.99 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.0 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 2.77 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.438 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.3599999999999999 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 2.9900000000000002 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.2599999999999998 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.0300000000000002 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.73 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 51' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.6200000000000001 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 52' ' ' MET . . . . . 0.444 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.29 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 5.8300000000000001 110.619 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 4.5199999999999996 110.626 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.0 109.913 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 CA-C-O 120.809 0.116 . . . . 3.5699999999999998 113.267 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.462 HD12 ' HD2' ' A' ' 8' ' ' ARG . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 4.6799999999999997 110.679 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.27 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.462 ' HD2' HD12 ' A' ' 6' ' ' ILE . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.4500000000000002 109.936 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 2.8900000000000001 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG22 ' H ' ' B' ' 32' ' ' ASP . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 2.9399999999999999 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.4400000000000004 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.6099999999999999 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.3499999999999996 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.0899999999999999 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 3.6099999999999999 110.383 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.3300000000000001 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.4100000000000001 110.927 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.1499999999999999 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.71 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.494 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 3.73 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.3099999999999996 110.452 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 3.5800000000000001 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 2.9500000000000002 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 3.8700000000000001 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.0899999999999999 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.4900000000000002 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.7400000000000002 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.1100000000000003 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 4.9900000000000002 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.1699999999999999 110.614 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.1200000000000001 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 2.9500000000000002 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 2.9500000000000002 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.5099999999999998 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.75 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.1299999999999999 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.1800000000000002 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.6800000000000002 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.2800000000000002 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.1699999999999999 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 2.9100000000000001 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.2599999999999998 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.1000000000000001 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.4399999999999999 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.3899999999999997 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.1399999999999997 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.4199999999999999 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 4.54 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.0199999999999996 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 6.6799999999999997 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.4699999999999998 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 5.7699999999999996 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m . . . . . 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.5499999999999998 110.12 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.1100000000000003 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.25 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 3.3199999999999998 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.4699999999999998 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.3999999999999999 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 3.48 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ASP . . . . . 0.478 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.5199999999999996 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.481 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.8899999999999997 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 3.8199999999999998 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.7000000000000002 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.478 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 3.7799999999999998 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.0 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 2.9100000000000001 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.4399999999999999 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.5699999999999998 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.2800000000000002 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.7400000000000002 111.227 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 3.6499999999999999 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 3.98 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 4.7999999999999998 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.4100000000000001 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 4.8499999999999996 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 3.6899999999999999 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.0099999999999998 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.4299999999999997 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.489 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.5599999999999996 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.498 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.4699999999999998 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 1.98 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.3999999999999999 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.0 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.5 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.3899999999999997 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 42' ' ' LYS . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.6000000000000001 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.7400000000000002 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.3799999999999999 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 3.7599999999999998 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.3499999999999996 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.4199999999999999 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 2.6899999999999999 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.3599999999999999 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.21 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 3.6600000000000001 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.2000000000000002 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.0999999999999996 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 3.8100000000000001 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.2000000000000002 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.1900000000000004 109.812 179.322 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.591 -0.151 . . . . 5.0099999999999998 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.25 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.4700000000000002 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 3.96 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.5299999999999998 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 3.6000000000000001 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 2.6400000000000001 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.567 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 2.7000000000000002 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 11' ' ' ASP . . . . . 0.691 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.5699999999999998 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 12' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.3900000000000001 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 14' ' ' GLY . . . . . 0.585 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.1600000000000001 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.691 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.0499999999999998 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 2.6400000000000001 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.4399999999999999 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.3399999999999999 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.6600000000000001 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.46 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.1799999999999997 109.537 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.5299999999999998 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.2199999999999998 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.04 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.0199999999999996 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.0800000000000001 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.4699999999999998 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 3.6899999999999999 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 30' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.5800000000000001 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.1399999999999997 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.8199999999999998 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.2599999999999998 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 2.6600000000000001 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.25 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.2400000000000002 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 37' ' ' TYR . . . . . 0.418 ' HA ' ' O ' ' D' ' 3' ' ' SER . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.3999999999999999 108.763 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 38' ' ' VAL . . . . . 0.478 HG22 ' HB2' ' D' ' 3' ' ' SER . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 2.5499999999999998 111.883 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 39' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.1400000000000001 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 42' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 2.96 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.3199999999999998 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.27 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.4399999999999999 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 46' ' ' LYS . . . . . 0.483 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.02 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 2.96 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.2000000000000002 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.2400000000000002 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 3.7200000000000002 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.0099999999999998 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 5.6200000000000001 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.1200000000000001 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.3099999999999996 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 3.6899999999999999 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 2' ' ' LYS . . . . . 0.542 ' H ' HD12 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.5699999999999998 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.478 ' HB2' HG22 ' C' ' 38' ' ' VAL . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.6400000000000001 111.87 -178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.4399999999999999 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.9199999999999999 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 6' ' ' ILE . . . . . 0.542 HD12 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.4500000000000002 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.6099999999999999 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.77 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 9' ' ' LYS . . . . . 0.419 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.1499999999999999 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.797 HG13 ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.0800000000000001 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 11' ' ' ASP . . . . . 0.797 ' H ' HG13 ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.5899999999999999 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.494 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.0599999999999996 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.414 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 4.8399999999999999 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.4300000000000002 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.5099999999999998 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 2.75 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' C' ' 15' ' ' ARG . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.3599999999999999 110.788 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 18' ' ' ILE . . . . . 0.46 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.0800000000000001 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 19' ' ' PRO . . . . . 0.427 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.46 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 4.8200000000000003 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 21' ' ' GLU . . . . . 0.494 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.9800000000000004 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.25 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 23' ' ' ARG . . . . . 0.585 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 2.8799999999999999 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.0999999999999996 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 3.73 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 2.9700000000000002 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 2.79 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.1499999999999999 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.46 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.505 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.3999999999999999 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 3.4399999999999999 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.6600000000000001 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.2999999999999998 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.471 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.1099999999999999 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.3399999999999999 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.3300000000000001 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.1400000000000001 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 1.99 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.7599999999999998 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.3500000000000001 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.483 ' CB ' ' HB3' ' C' ' 46' ' ' LYS . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.3399999999999999 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.0 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 2.77 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.3599999999999999 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 2.9900000000000002 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.2599999999999998 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.0300000000000002 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 50' ' ' PRO . . . . . 0.408 ' HB2' ' SD ' ' D' ' 52' ' ' MET . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.73 111.258 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.6200000000000001 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 52' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' D' ' 50' ' ' PRO . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.29 110.33 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 5.8300000000000001 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 4.5199999999999996 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.0 110.153 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 N-CA-C 111.978 -0.449 . . . . 3.5699999999999998 111.978 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 4.6799999999999997 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.27 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.4500000000000002 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 2.8900000000000001 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 2.9399999999999999 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.4400000000000004 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' B' ' 23' ' ' ARG . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.6099999999999999 110.941 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.3499999999999996 110.68 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.0899999999999999 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.455 ' HG2' HG22 ' B' ' 17' ' ' VAL . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 3.6099999999999999 112.014 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.541 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.3300000000000001 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.44 ' HA ' ' HG2' ' B' ' 15' ' ' ARG . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.4100000000000001 112.172 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.515 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.1499999999999999 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HG2' HG11 ' B' ' 38' ' ' VAL . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.71 112.421 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 3.73 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.3099999999999996 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.429 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 3.5800000000000001 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 2.9500000000000002 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 3.8700000000000001 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.0899999999999999 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.4900000000000002 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.7400000000000002 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.1100000000000003 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 4.9900000000000002 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.1699999999999999 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.1200000000000001 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB1' ' HB ' ' B' ' 7' ' ' VAL . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 2.9500000000000002 111.174 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.426 ' HB2' ' HB3' ' B' ' 8' ' ' ARG . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 2.9500000000000002 109.846 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.5099999999999998 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' B' ' 8' ' ' ARG . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.75 110.629 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.1299999999999999 109.347 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.1800000000000002 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.406 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.6800000000000002 109.314 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.2800000000000002 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.1699999999999999 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 2.9100000000000001 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' B' ' 45' ' ' LEU . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.2599999999999998 109.84 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.1000000000000001 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.4399999999999999 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.3899999999999997 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HB2' ' HB2' ' B' ' 41' ' ' GLU . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.1399999999999997 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.4199999999999999 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 4.54 110.228 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.0199999999999996 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 6.6799999999999997 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.4699999999999998 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 5.7699999999999996 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.5499999999999998 110.222 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 112.297 -0.321 . . . . 4.1100000000000003 112.297 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.25 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.412 ' HB ' ' HB1' ' A' ' 33' ' ' ALA . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 3.3199999999999998 110.868 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.556 ' HB2' HD11 ' A' ' 36' ' ' ILE . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.4699999999999998 109.662 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.3999999999999999 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' VAL . . . . . 0.484 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 3.48 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.5199999999999996 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.8899999999999997 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' B' ' 13' ' ' LEU . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 3.8199999999999998 109.846 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.7000000000000002 114.105 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.515 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 3.7799999999999998 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.541 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.0 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.455 HG22 ' HG2' ' A' ' 15' ' ' ARG . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 2.9100000000000001 110.841 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.4399999999999999 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' PRO . . . . . 0.471 ' HD2' HG23 ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.5699999999999998 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ILE . . . . . 0.41 ' H ' HG13 ' B' ' 20' ' ' ILE . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.2800000000000002 111.34 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.7400000000000002 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' LEU . . . . . 0.401 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 3.6499999999999999 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.444 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 3.98 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 4.7999999999999998 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.4100000000000001 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 4.8499999999999996 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 3.6899999999999999 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.0099999999999998 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.4299999999999997 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.5599999999999996 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.4699999999999998 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 1.98 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' B' ' 45' ' ' LEU . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.3999999999999999 110.042 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.0 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.5 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.3899999999999997 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.454 HG11 ' HG2' ' A' ' 19' ' ' PRO . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.6000000000000001 110.813 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.446 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.7400000000000002 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.3799999999999999 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 3.7599999999999998 110.554 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.3499999999999996 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.4199999999999999 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 2.6899999999999999 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.419 ' HB3' HD21 ' B' ' 34' ' ' LEU . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.3599999999999999 108.33 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.21 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 3.6600000000000001 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' TYR . . . . . 0.44 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.2000000000000002 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.0999999999999996 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 3.8100000000000001 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.2000000000000002 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.1900000000000004 110.454 -179.593 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.579 0.585 . . . . 5.0099999999999998 112.579 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.25 109.763 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.4700000000000002 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 3.96 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.5299999999999998 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 3.6000000000000001 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 2.6400000000000001 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 2.7000000000000002 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.5699999999999998 108.671 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 13' ' ' LEU . . . . . 0.844 HD11 ' HA ' ' D' ' 20' ' ' ILE . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.3900000000000001 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.1600000000000001 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 15' ' ' ARG . . . . . 0.526 ' CZ ' ' HB3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.0499999999999998 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 16' ' ' VAL . . . . . 0.543 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 2.6400000000000001 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 17' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.4399999999999999 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.3399999999999999 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.6600000000000001 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.46 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.1799999999999997 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 22' ' ' LEU . . . . . 0.665 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.5299999999999998 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 23' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.2199999999999998 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.04 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 26' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.0199999999999996 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.0800000000000001 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.4699999999999998 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 3.6899999999999999 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.5800000000000001 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.1399999999999997 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.8199999999999998 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.2599999999999998 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 2.6600000000000001 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 35' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.25 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.2400000000000002 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.3999999999999999 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 38' ' ' VAL . . . . . 0.48 HG13 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 2.5499999999999998 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.1400000000000001 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 2.96 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 43' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.3199999999999998 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.27 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.4399999999999999 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.02 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 2.96 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 48' ' ' TYR . . . . . 0.551 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.2000000000000002 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.2400000000000002 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 3.7200000000000002 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.0099999999999998 110.189 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 53' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 5.6200000000000001 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 54' ' ' CYS . . . . . 0.419 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.1200000000000001 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.3099999999999996 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 1' ' ' MET . . . . . 0.431 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 3.6899999999999999 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.5699999999999998 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 3' ' ' SER . . . . . 0.48 ' CB ' HG13 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.6400000000000001 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.4399999999999999 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.9199999999999999 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.4500000000000002 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 7' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.6099999999999999 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 8' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.77 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 9' ' ' LYS . . . . . 0.436 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.1499999999999999 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 10' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.0800000000000001 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.5899999999999999 109.93 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 12' ' ' GLU . . . . . 0.43 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.0599999999999996 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 13' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' D' ' 13' ' ' LEU . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 4.8399999999999999 109.6 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.4300000000000002 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.534 ' HA ' ' HA ' ' C' ' 17' ' ' VAL . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.5099999999999998 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 16' ' ' VAL . . . . . 0.543 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 2.75 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 17' ' ' VAL . . . . . 0.441 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.3599999999999999 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.0800000000000001 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 19' ' ' PRO . . . . . 0.448 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.46 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 20' ' ' ILE . . . . . 0.844 ' HA ' HD11 ' C' ' 13' ' ' LEU . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 4.8200000000000003 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.9800000000000004 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 22' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.25 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 2.8799999999999999 111.682 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 24' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.0999999999999996 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 3.73 110.296 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 2.9700000000000002 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 2.79 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.1499999999999999 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.46 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 30' ' ' GLU . . . . . 0.554 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.3999999999999999 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 3.4399999999999999 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.6600000000000001 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.1099999999999999 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.3399999999999999 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.3300000000000001 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.2400000000000002 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.1400000000000001 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 1.99 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.7599999999999998 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 41' ' ' GLU . . . . . 0.646 ' HA ' HD22 ' C' ' 26' ' ' LEU . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.3500000000000001 111.382 -179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.3399999999999999 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 1.99 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 45' ' ' LEU . . . . . 0.519 HD23 HG11 ' C' ' 16' ' ' VAL . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 2.77 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.3599999999999999 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 2.9900000000000002 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.2599999999999998 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 49' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.0300000000000002 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 50' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.73 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.6200000000000001 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.29 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 5.8300000000000001 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 4.5199999999999996 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.0 110.197 -179.019 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 tpt . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.743 0.306 . . . . 9.4199999999999999 110.336 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 37.7 mmtt -140.14 -171.49 3.2 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.124 -0.489 . . . . 10.67 109.971 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -73.02 88.2 1.39 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.979 0.418 . . . . 7.75 110.548 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -159.67 153.73 23.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.066 -0.515 . . . . 5.6600000000000001 110.39 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.77 -151.25 5.39 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.957 -0.639 . . . . 3.5699999999999998 111.901 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 4.6799999999999997 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.27 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.4500000000000002 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 2.8900000000000001 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 2.9399999999999999 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.4400000000000004 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.6099999999999999 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.3499999999999996 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.0899999999999999 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 3.6099999999999999 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.3300000000000001 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.53 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.4100000000000001 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.1499999999999999 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HG2' HG21 ' B' ' 36' ' ' ILE . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.71 113.449 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 3.73 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.3099999999999996 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.452 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 3.5800000000000001 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.543 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 2.9500000000000002 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 3.8700000000000001 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.43 HG23 ' HG3' ' D' ' 2' ' ' LYS . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.0899999999999999 111.035 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.4900000000000002 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.7400000000000002 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.1100000000000003 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 4.9900000000000002 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.1699999999999999 111.671 -178.569 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.1200000000000001 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.527 ' O ' HG22 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 2.9500000000000002 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 2.9500000000000002 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' B' ' 8' ' ' ARG . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.75 110.002 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.1299999999999999 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.1800000000000002 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.6800000000000002 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.2800000000000002 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.1699999999999999 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 2.9100000000000001 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.2599999999999998 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.1000000000000001 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.562 HD22 HD11 ' B' ' 45' ' ' LEU . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.4399999999999999 110.175 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.3899999999999997 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 50' ' ' PRO . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.1399999999999997 108.969 178.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.4199999999999999 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 4.54 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.406 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.0199999999999996 112.329 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 6.6799999999999997 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.4699999999999998 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 5.7699999999999996 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.13 -10.12 26.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.5499999999999998 110.424 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 6.7999999999999998 110.264 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.577 0.703 . . . . 10.279999999999999 109.547 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -92.47 -156.55 0.47 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.998 -1.001 . . . . 9.0299999999999994 109.63 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m -86.18 64.88 8.81 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.049 -0.352 . . . . 6.5800000000000001 110.049 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -33.63 56.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 5.3399999999999999 111.503 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.12 124.54 1.31 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.85 -0.691 . . . . 4.1100000000000003 111.463 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.676 HG23 ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.25 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.676 ' H ' HG23 ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 3.3199999999999998 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.4699999999999998 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.3999999999999999 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 3.48 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.5199999999999996 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.8899999999999997 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 13' ' ' LEU . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 3.8199999999999998 110.376 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLY . . . . . 0.543 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.7000000000000002 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 3.7799999999999998 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.45 HG11 HD21 ' A' ' 45' ' ' LEU . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.0 108.096 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG11 ' OP2' ' E' ' 7' ' ' ' DG' . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 2.9100000000000001 112.247 -178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.4399999999999999 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.5699999999999998 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.484 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.2800000000000002 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.7400000000000002 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 3.6499999999999999 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 3.98 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 4.7999999999999998 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.4100000000000001 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 4.8499999999999996 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 3.6899999999999999 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.0099999999999998 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.4299999999999997 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.5599999999999996 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.4699999999999998 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.3999999999999999 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.0 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.542 HG21 ' HG2' ' A' ' 19' ' ' PRO . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.5 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.489 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.3899999999999997 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.6000000000000001 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.7400000000000002 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.3799999999999999 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.407 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 3.7599999999999998 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.3499999999999996 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.4199999999999999 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 2.6899999999999999 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.562 HD11 HD22 ' A' ' 45' ' ' LEU . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.3599999999999999 110.715 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.426 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.21 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.426 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 3.6600000000000001 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.2000000000000002 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.0999999999999996 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 3.8100000000000001 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.2000000000000002 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.59 123.55 27.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.1900000000000004 110.329 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.52 -36.1 13.92 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 5.4199999999999999 111.472 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 18.4 t -155.34 161.09 41.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 5.5199999999999996 110.041 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' D' ' 55' ' ' GLN . 27.7 mt-30 . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.411 -0.359 . . . . 6.3799999999999999 110.488 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 82.0 mmm . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.298 0.571 . . . . 7.7999999999999998 110.398 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -61.13 123.99 19.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.438 -0.801 . . . . 8.5700000000000003 111.246 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 3' ' ' SER . . . . . 0.424 ' HB2' ' HB3' ' C' ' 19' ' ' PRO . 1.8 m -127.14 26.52 6.05 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.399 -0.819 . . . . 5.0099999999999998 109.069 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 4' ' ' THR . . . . . 0.54 HG23 HG12 ' D' ' 38' ' ' VAL . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.25 110.354 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.4700000000000002 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 3.96 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.5299999999999998 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 3.6000000000000001 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 2.6400000000000001 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 2.7000000000000002 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.5699999999999998 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.517 ' HG ' ' H41' ' F' ' 9' ' ' ' DC' . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.3900000000000001 111.037 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.1600000000000001 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.55 HH11 HG22 ' D' ' 17' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.0499999999999998 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 2.6400000000000001 111.86 -178.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.4399999999999999 111.362 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.3399999999999999 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' PRO . . . . . 0.424 ' HB3' ' HB2' ' C' ' 3' ' ' SER . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.6600000000000001 112.579 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.46 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.1799999999999997 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.5299999999999998 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' C' ' 26' ' ' LEU . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.2199999999999998 110.805 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.04 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.0199999999999996 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.0800000000000001 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.4699999999999998 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 3.6899999999999999 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' GLU . . . . . 0.453 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.5800000000000001 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.1399999999999997 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 32' ' ' ASP . . . . . 0.468 ' O ' HG23 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.8199999999999998 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 33' ' ' ALA . . . . . 0.524 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.2599999999999998 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 2.6600000000000001 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.25 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.2400000000000002 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.522 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.3999999999999999 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 38' ' ' VAL . . . . . 0.535 HG13 ' HB2' ' D' ' 3' ' ' SER . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 2.5499999999999998 112.627 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.1400000000000001 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 2.96 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.3199999999999998 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.27 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.4399999999999999 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.02 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 2.96 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.2000000000000002 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.2400000000000002 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 3.7200000000000002 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 52' ' ' MET . . . . . 0.403 ' HB3' ' HB3' ' C' ' 55' ' ' GLN . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.0099999999999998 110.007 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 5.6200000000000001 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.1200000000000001 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 55' ' ' GLN . . . . . 0.403 ' HB3' ' HB3' ' C' ' 52' ' ' MET . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.3099999999999996 110.492 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 3.6899999999999999 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 2' ' ' LYS . . . . . 0.43 ' HG3' HG23 ' A' ' 25' ' ' THR . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.5699999999999998 110.509 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.535 ' HB2' HG13 ' C' ' 38' ' ' VAL . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.6400000000000001 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.4399999999999999 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.9199999999999999 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.4500000000000002 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.6099999999999999 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.77 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.1499999999999999 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.571 HG12 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.0800000000000001 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.5899999999999999 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.0599999999999996 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.469 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 4.8399999999999999 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.4300000000000002 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.571 ' H ' HG12 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.5099999999999998 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 2.75 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.55 HG22 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.3599999999999999 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.0800000000000001 109.778 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.46 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 20' ' ' ILE . . . . . 0.494 ' H ' HD12 ' D' ' 20' ' ' ILE . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 4.8200000000000003 111.523 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 21' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.9800000000000004 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.25 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 2.8799999999999999 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.0999999999999996 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 3.73 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 2.9700000000000002 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 2.79 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.1499999999999999 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.46 110.369 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.3999999999999999 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 3.4399999999999999 109.151 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.6600000000000001 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.2999999999999998 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.1099999999999999 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.3399999999999999 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.3300000000000001 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.2400000000000002 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 38' ' ' VAL . . . . . 0.54 HG12 HG23 ' C' ' 4' ' ' THR . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.1400000000000001 110.777 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.478 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 1.99 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 40' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.7599999999999998 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.3500000000000001 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.3399999999999999 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 43' ' ' ILE . . . . . 0.496 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 1.99 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.0 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 2.77 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.3599999999999999 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 2.9900000000000002 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.483 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.2599999999999998 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.0300000000000002 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 50' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.73 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.6200000000000001 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.29 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 5.8300000000000001 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 4.5199999999999996 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 55' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' B' ' 55' ' ' GLN . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.0 110.11 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.676 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 O4'-C1'-C2' 106.963 0.784 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.676 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 N19-C1'-C2' 117.169 1.855 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.682 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O4'-C1'-N19 109.404 2.005 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.682 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.114 1.642 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.6 " C2'" ' H72' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-N19 109.483 2.103 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.703 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O3'-P-O5' 100.26 -1.968 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.703 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 O4'-C1'-N19 109.609 2.262 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.607 ' C8 ' " H1'" ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O3'-P-O5' 100.982 -1.588 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.549 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 O3'-P-O5' 100.249 -1.974 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.628 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.243 -1.977 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.628 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.719 2.399 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.559 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.754 0 O4'-C1'-N19 109.545 2.181 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.581 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.878 0 O3'-P-O5' 99.567 -2.333 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.581 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.797 2.497 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.531 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.811 0 O3'-P-O5' 99.489 -2.374 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.531 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.957 2.696 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.494 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.775 0 O4'-C1'-N19 109.586 2.233 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.576 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 109.573 2.216 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.729 0 O4'-C1'-N19 109.458 2.073 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.517 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.808 0 O4'-C1'-N19 109.518 2.147 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.559 2.198 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.514 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 O4'-C1'-N19 109.708 2.385 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.533 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.687 0 O3'-P-O5' 99.842 -2.188 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.639 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O3'-P-O5' 100.709 -1.732 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.639 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 N19-C1'-C2' 116.196 1.247 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.752 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C4'-C3'-C2' 102.401 -0.799 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.752 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.845 0 N19-C1'-C2' 116.84 1.65 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.603 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.498 3.372 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.457 " H2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-N19 109.703 2.378 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.457 ' H72' " H2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 99.766 -2.228 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.799 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.785 0 O3'-P-O5' 99.372 -2.436 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.799 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 O4'-C1'-N19 109.647 2.309 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.532 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O3'-P-O5' 99.916 -2.149 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.517 ' H41' ' HG ' ' C' ' 13' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.599 2.249 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.53 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 109.366 1.957 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.419 -0.934 0 O4'-C1'-N19 109.671 2.339 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.112 0 O3'-P-O5' 99.21 -2.521 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.775 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.423 -0.652 0 O3'-P-O5' 99.722 -2.251 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.775 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -1.024 0 O4'-C1'-N19 109.892 2.615 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.703 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.838 0 O3'-P-O5' 99.607 -2.312 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.703 ' H71' H2'' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 O4'-C1'-N19 109.49 2.112 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.527 " C2'" ' H72' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O3'-P-O5' 99.495 -2.371 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.527 ' H72' " C2'" ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O3'-P-O5' 99.3 -2.474 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.791 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.803 0 N19-C1'-C2' 118.104 2.44 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.791 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O4'-C1'-N19 109.577 2.221 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C1'-N19 109.42 2.025 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.584 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.598 0 O3'-P-O5' 100.047 -2.08 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.696 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 O3'-P-O5' 100.461 -1.863 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.696 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O3'-P-O5' 101.31 -1.416 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.456 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.53 0.664 0 N19-C1'-C2' 116.207 1.254 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.2 ttm . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 121.059 0.457 . . . . 9.4199999999999999 110.558 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.57 136.28 2.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.863 -0.608 . . . . 10.67 109.703 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.0 m -141.45 168.97 18.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.216 -0.447 . . . . 7.75 110.068 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 m -92.42 -53.72 4.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.214 0.53 . . . . 5.6600000000000001 110.047 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -107.13 102.47 1.84 Allowed Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.5699999999999998 110.987 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 4.6799999999999997 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.27 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.4500000000000002 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 2.8900000000000001 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 2.9399999999999999 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.717 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.4400000000000004 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.6099999999999999 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.534 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.3499999999999996 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.0899999999999999 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 3.6099999999999999 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.69 HG21 HG23 ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.3300000000000001 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.4100000000000001 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.1499999999999999 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.71 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.405 HG12 H5'' ' F' ' 14' ' ' ' DA' . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 3.73 109.848 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.3099999999999996 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 3.5800000000000001 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 2.9500000000000002 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 3.8700000000000001 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.0899999999999999 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.4900000000000002 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.7400000000000002 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.1100000000000003 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 4.9900000000000002 111.279 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.433 ' O ' HG21 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.1699999999999999 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.1200000000000001 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 2.9500000000000002 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 2.9500000000000002 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.513 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.5099999999999998 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.75 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.1299999999999999 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.406 HG12 HG22 ' A' ' 43' ' ' ILE . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.1800000000000002 110.651 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.6800000000000002 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.2800000000000002 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.1699999999999999 110.495 179.277 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 2.9100000000000001 110.137 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.406 HG22 HG12 ' A' ' 38' ' ' VAL . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.2599999999999998 110.568 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.1000000000000001 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.4399999999999999 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.3899999999999997 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.1399999999999997 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.4199999999999999 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HA ' ' HD2' ' A' ' 50' ' ' PRO . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 4.54 109.798 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HB2' ' A' ' 29' ' ' ALA . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.0199999999999996 112.784 -178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 6.6799999999999997 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.4699999999999998 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 5.7699999999999996 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t 67.62 87.34 0.12 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.5499999999999998 110.939 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.834 -0.621 . . . . 6.7999999999999998 110.168 179.589 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.0 ttt . . . . . 0 C--O 1.236 0.342 0 CA-C-O 120.439 0.161 . . . . 10.279999999999999 110.581 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 84.5 mttt 60.18 86.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.715 0.634 . . . . 9.0299999999999994 111.411 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -82.55 137.73 34.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.138 -0.483 . . . . 6.5800000000000001 110.605 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -82.14 -28.09 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.252 0.548 . . . . 5.3399999999999999 110.33 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.01 123.72 1.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.1100000000000003 111.211 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.25 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 3.3199999999999998 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.4699999999999998 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.3999999999999999 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.578 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 3.48 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.5199999999999996 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.507 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.8899999999999997 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 3.8199999999999998 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.7000000000000002 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.437 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 3.7799999999999998 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.578 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.0 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 2.9100000000000001 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.69 HG23 HG21 ' A' ' 16' ' ' VAL . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.4399999999999999 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.5699999999999998 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.2800000000000002 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.7400000000000002 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' B' ' 22' ' ' LEU . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 3.6499999999999999 110.483 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 3.98 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 4.7999999999999998 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.4100000000000001 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 4.8499999999999996 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 3.6899999999999999 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.0099999999999998 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.4299999999999997 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.5599999999999996 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.4699999999999998 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 1.98 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.3999999999999999 110.456 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.5 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.405 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.3899999999999997 109.404 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.6000000000000001 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.7400000000000002 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.3799999999999999 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 3.7599999999999998 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.3499999999999996 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.4199999999999999 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 2.6899999999999999 111.014 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.3599999999999999 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.21 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 3.6600000000000001 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.2000000000000002 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.0999999999999996 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 3.8100000000000001 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.2000000000000002 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 81.8 1.13 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.1900000000000004 110.254 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.13 145.99 25.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.205 -0.452 . . . . 5.4199999999999999 111.375 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -71.23 115.03 9.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.697 -0.683 . . . . 5.5199999999999996 109.594 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.506 -0.315 . . . . 6.3799999999999999 110.554 -179.872 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.435 ' H3 ' ' HG2' ' C' ' 21' ' ' GLU . 1.1 mtt . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.723 0.297 . . . . 7.7999999999999998 110.37 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -161.1 74.34 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.03 -0.532 . . . . 8.5700000000000003 111.143 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -86.15 45.89 1.27 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.345 0.593 . . . . 5.0099999999999998 110.177 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.25 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.4700000000000002 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 3.96 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.5299999999999998 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 3.6000000000000001 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 9' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 2.6400000000000001 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.557 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 2.7000000000000002 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 11' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.5699999999999998 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.49 HD22 ' HA ' ' C' ' 13' ' ' LEU . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.3900000000000001 110.064 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.1600000000000001 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.569 ' NE ' HG22 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.0499999999999998 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.411 ' H ' HG13 ' D' ' 16' ' ' VAL . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 2.6400000000000001 110.906 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 17' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.4399999999999999 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.408 HG23 ' NE ' ' C' ' 23' ' ' ARG . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.3399999999999999 109.329 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.6600000000000001 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.46 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' GLU . . . . . 0.435 ' HG2' ' H3 ' ' C' ' 1' ' ' MET . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.1799999999999997 110.648 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.428 HD21 ' HB ' ' D' ' 38' ' ' VAL . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.5299999999999998 110.229 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.489 HH22 " C3'" ' F' ' 5' ' ' ' DT' . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.2199999999999998 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ARG . . . . . 0.404 ' NH1' ' HB2' ' C' ' 21' ' ' GLU . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.04 108.982 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.0199999999999996 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.0800000000000001 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 28' ' ' ILE . . . . . 0.443 HD13 ' HG2' ' D' ' 41' ' ' GLU . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.4699999999999998 111.829 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 3.6899999999999999 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 30' ' ' GLU . . . . . 0.44 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.5800000000000001 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.1399999999999997 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.8199999999999998 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.2599999999999998 109.712 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.518 HD23 HG22 ' D' ' 10' ' ' VAL . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 2.6600000000000001 111.192 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.46 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.25 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' D' ' 8' ' ' ARG . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.2400000000000002 110.779 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.3999999999999999 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 2.5499999999999998 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 39' ' ' ASP . . . . . 0.441 ' CB ' HD13 ' C' ' 44' ' ' ILE . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.1400000000000001 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 2.96 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.3199999999999998 109.863 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 44' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' C' ' 39' ' ' ASP . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.27 110.794 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.503 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.4399999999999999 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.02 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 2.96 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.2400000000000002 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 3.7200000000000002 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.0099999999999998 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 5.6200000000000001 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.1200000000000001 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.3099999999999996 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 3.6899999999999999 110.503 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.5699999999999998 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.6400000000000001 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.4399999999999999 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.9199999999999999 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.4500000000000002 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.6099999999999999 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.58 ' HB2' HD11 ' C' ' 36' ' ' ILE . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.77 109.101 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.1499999999999999 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.518 HG22 HD23 ' C' ' 34' ' ' LEU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.0800000000000001 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.5899999999999999 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.0599999999999996 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 4.8399999999999999 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.4300000000000002 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.5099999999999998 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 2.75 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.569 HG22 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.3599999999999999 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.0800000000000001 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.46 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 20' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 4.8200000000000003 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' D' ' 24' ' ' ARG . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.9800000000000004 109.904 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.25 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 23' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 2.8799999999999999 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 24' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' D' ' 21' ' ' GLU . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.0999999999999996 110.019 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 3.73 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 2.9700000000000002 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 2.79 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.1499999999999999 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.46 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.663 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.3999999999999999 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 3.4399999999999999 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 32' ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.6600000000000001 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.2999999999999998 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.1099999999999999 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.3399999999999999 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.3300000000000001 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 37' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.2400000000000002 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 38' ' ' VAL . . . . . 0.428 ' HB ' HD21 ' C' ' 22' ' ' LEU . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.1400000000000001 111.042 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 1.99 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.7599999999999998 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 41' ' ' GLU . . . . . 0.443 ' HG2' HD13 ' C' ' 28' ' ' ILE . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.3500000000000001 110.919 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.3399999999999999 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 43' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 1.99 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 44' ' ' ILE . . . . . 0.471 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.0 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 2.77 110.181 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.3599999999999999 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 47' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 2.9900000000000002 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.452 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.2599999999999998 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.0300000000000002 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.73 111.946 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.6200000000000001 110.187 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.29 110.25 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 5.8300000000000001 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 4.5199999999999996 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.0 110.152 -179.764 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.704 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.489 0 O4'-C1'-C2' 107.215 1.014 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.704 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 N19-C1'-C2' 117.255 1.91 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.75 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O3'-P-O5' 101.26 -1.442 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.75 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-N19 109.76 2.45 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.621 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.413 2.017 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.646 " H1'" ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.19 1.738 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.693 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 109.283 1.854 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.693 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.756 0 O4'-C1'-N19 109.66 2.325 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.739 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O3'-P-O5' 100.369 -1.911 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.739 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-N19 109.421 2.027 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.486 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-N19 109.565 2.206 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.492 " C2'" ' H72' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.898 2.622 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.609 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.621 0 O4'-C1'-N19 109.646 2.308 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.609 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-N19 109.437 2.046 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.584 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 O4'-C1'-N19 109.847 2.559 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.584 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O3'-P-O5' 99.598 -2.317 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.473 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O4'-C1'-N19 109.735 2.419 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.63 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.714 0 O3'-P-O5' 99.513 -2.362 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-N19 109.425 2.032 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.673 0 O4'-C1'-N19 109.634 2.292 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.458 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.796 0 O4'-C1'-N19 109.361 1.951 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.466 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-N19 109.594 2.242 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.638 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.465 0 O4'-C1'-N19 109.69 2.362 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.638 ' H71' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.607 0 O3'-P-O5' 100.382 -1.904 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.622 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.529 0.567 0 N19-C1'-C2' 115.931 1.082 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.72 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O5'-C5'-C4' 111.585 0.99 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.72 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.869 0 N19-C1'-C2' 116.786 1.616 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.607 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 O4'-C1'-N19 109.762 2.453 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.417 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.955 2.694 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.593 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O3'-P-O5' 99.694 -2.266 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.593 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-N19 109.557 2.197 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.547 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.837 0 O4'-C1'-N19 109.603 2.254 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.551 H2'' ' C5 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.87 0 O3'-P-O5' 99.566 -2.334 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.551 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.86 0 O4'-C1'-N19 110.186 2.983 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.527 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O3'-P-O5' 99.499 -2.369 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.527 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.427 2.033 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.728 " H1'" ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.774 0 N19-C1'-C2' 118.103 2.439 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.728 ' C8 ' " H1'" ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C1'-N19 109.871 2.588 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.457 " C2'" ' H72' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.708 0 O3'-P-O5' 99.224 -2.514 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.473 " C2'" ' H72' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 O4'-C1'-N19 109.819 2.524 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.733 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.772 0 O3'-P-O5' 99.788 -2.217 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.733 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C1'-N19 110.052 2.815 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.621 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.823 0 O3'-P-O5' 100.189 -2.006 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.621 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.795 0 O4'-C1'-N19 110.077 2.847 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.647 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.872 0 O3'-P-O5' 100.084 -2.061 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.647 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.072 0 O4'-C1'-N19 109.8 2.5 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.757 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.597 0 O3'-P-O5' 100.224 -1.987 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.757 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 N19-C1'-C2' 116.997 1.748 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.656 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.781 1.227 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.584 ' H71' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 N19-C1'-C2' 115.973 1.108 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.567 ' N ' ' HB3' ' D' ' 21' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 110.114 -0.328 . . . . 9.4199999999999999 110.114 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HE2' ' OG1' ' D' ' 25' ' ' THR . 0.0 OUTLIER -105.54 147.7 28.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 10.67 111.339 -179.533 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.423 ' CB ' ' HB ' ' B' ' 38' ' ' VAL . 0.0 OUTLIER -78.92 -2.65 40.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.606 -0.724 . . . . 7.75 111.72 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.49 -7.19 41.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.262 -0.426 . . . . 5.6600000000000001 112.01 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 122.55 88.62 0.92 Allowed Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.697 -0.763 . . . . 3.5699999999999998 112.291 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 4.6799999999999997 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.27 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.4500000000000002 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 2.8900000000000001 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 2.9399999999999999 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.4400000000000004 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.6099999999999999 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.447 HD21 ' N7 ' ' F' ' 17' ' ' ' DG' . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.3499999999999996 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.0899999999999999 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 3.6099999999999999 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.3300000000000001 110.776 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.4100000000000001 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.1499999999999999 111.077 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.71 112.608 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 3.73 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.3099999999999996 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 3.5800000000000001 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 2.9500000000000002 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 3.8700000000000001 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.0899999999999999 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.4900000000000002 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.7400000000000002 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.1100000000000003 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 4.9900000000000002 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.1699999999999999 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.572 ' HA ' HG11 ' B' ' 10' ' ' VAL . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.1200000000000001 111.341 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 2.9500000000000002 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 2.9500000000000002 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 7' ' ' VAL . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.5099999999999998 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.75 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.535 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.1299999999999999 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.1800000000000002 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.535 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.6800000000000002 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.2800000000000002 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.1699999999999999 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 2.9100000000000001 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.2599999999999998 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.1000000000000001 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.4399999999999999 110.264 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.3899999999999997 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.1399999999999997 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.4199999999999999 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 4.54 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.0199999999999996 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 6.6799999999999997 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.4699999999999998 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 5.7699999999999996 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.66 86.91 7.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.5499999999999998 110.168 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.218 -0.446 . . . . 6.7999999999999998 111.121 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 C--O 1.233 0.198 0 CA-C-O 121.076 0.465 . . . . 10.279999999999999 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.503 ' HA ' HD21 ' B' ' 22' ' ' LEU . 14.7 mptt -67.11 136.16 54.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.894 -0.594 . . . . 9.0299999999999994 110.743 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' SER . . . . . 0.527 ' H ' HD11 ' B' ' 22' ' ' LEU . 0.8 OUTLIER -75.83 92.52 3.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.18 -0.464 . . . . 6.5800000000000001 110.514 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.4 79.95 6.2 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.199 -0.455 . . . . 5.3399999999999999 111.829 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.35 54.43 1.02 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.771 -0.728 . . . . 4.1100000000000003 111.99 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.25 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.611 HG22 ' HG2' ' A' ' 35' ' ' GLU . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 3.3199999999999998 110.153 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.4699999999999998 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.3999999999999999 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 31' ' ' LYS . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 3.48 112.093 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.5199999999999996 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.8899999999999997 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.464 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 3.8199999999999998 110.251 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.7000000000000002 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 3.7799999999999998 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.0 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.528 HG12 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 2.9100000000000001 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.528 ' H ' HG12 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.4399999999999999 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' PRO . . . . . 0.457 ' HD2' HG13 ' B' ' 18' ' ' ILE . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.5699999999999998 113.97 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.524 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.2800000000000002 111.535 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.7400000000000002 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' LEU . . . . . 0.527 HD11 ' H ' ' B' ' 3' ' ' SER . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 3.6499999999999999 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 3.98 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 4.7999999999999998 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.4100000000000001 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 4.8499999999999996 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 3.6899999999999999 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.0099999999999998 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.4299999999999997 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.5599999999999996 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.4699999999999998 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 1.98 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.415 HD13 HD23 ' B' ' 45' ' ' LEU . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.3999999999999999 110.335 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.0 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.5 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.3899999999999997 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.423 ' HB ' ' CB ' ' A' ' 3' ' ' SER . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.6000000000000001 109.678 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.7400000000000002 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.3799999999999999 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 3.7599999999999998 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.3499999999999996 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.4199999999999999 111.688 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 2.6899999999999999 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.415 HD23 HD13 ' B' ' 34' ' ' LEU . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.3599999999999999 110.962 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.21 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 3.6600000000000001 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.2000000000000002 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.478 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.0999999999999996 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 3.8100000000000001 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.2000000000000002 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.51 174.56 7.21 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.1900000000000004 111.219 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 139.11 58.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 5.4199999999999999 111.241 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 11.1 t -88.03 131.46 34.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.181 -0.463 . . . . 5.5199999999999996 110.276 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.326 -0.397 . . . . 6.3799999999999999 110.863 -179.867 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 80.4 mtp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.154 0.502 . . . . 7.7999999999999998 110.679 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -113.7 23.74 12.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.873 -0.603 . . . . 8.5700000000000003 109.969 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.17 -14.35 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.59 -0.732 . . . . 5.0099999999999998 111.563 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.25 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.4700000000000002 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' ILE . . . . . 0.426 ' H ' HG13 ' C' ' 6' ' ' ILE . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 3.96 110.11 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.5299999999999998 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 3.6000000000000001 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 2.6400000000000001 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.419 HG22 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 2.7000000000000002 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.5699999999999998 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.591 HD21 ' N4 ' ' F' ' 8' ' ' ' DC' . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.3900000000000001 109.973 179.339 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 14' ' ' GLY . . . . . 0.438 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.1600000000000001 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.66 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.0499999999999998 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.482 HG21 HD12 ' D' ' 34' ' ' LEU . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 2.6400000000000001 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.4399999999999999 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.44 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.3399999999999999 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.6600000000000001 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.46 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.1799999999999997 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.5299999999999998 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.461 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.2199999999999998 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ARG . . . . . 0.495 HH21 " H3'" ' F' ' 4' ' ' ' DG' . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.04 109.638 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.0199999999999996 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 27' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.0800000000000001 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 28' ' ' ILE . . . . . 0.474 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.4699999999999998 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 3.6899999999999999 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.5800000000000001 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 31' ' ' LYS . . . . . 0.575 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.1399999999999997 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 32' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.8199999999999998 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.2599999999999998 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 2.6600000000000001 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.25 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.2400000000000002 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' D' ' 3' ' ' SER . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.3999999999999999 109.017 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 2.5499999999999998 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.1400000000000001 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 2.96 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.3199999999999998 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.27 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.436 HD23 HD13 ' C' ' 34' ' ' LEU . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.4399999999999999 109.861 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.02 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 47' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' C' ' 47' ' ' LYS . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 2.96 109.352 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.2000000000000002 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.2400000000000002 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 3.7200000000000002 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.0099999999999998 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 5.6200000000000001 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.1200000000000001 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.3099999999999996 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 3.6899999999999999 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 2' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' D' ' 6' ' ' ILE . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.5699999999999998 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.6400000000000001 111.957 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.4399999999999999 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.9199999999999999 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 6' ' ' ILE . . . . . 0.423 HD12 ' HB2' ' D' ' 2' ' ' LYS . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.4500000000000002 110.102 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.6099999999999999 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.77 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.1499999999999999 112.009 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.0800000000000001 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.575 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.5899999999999999 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.0599999999999996 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 4.8399999999999999 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.4300000000000002 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.534 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.5099999999999998 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 2.75 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.3599999999999999 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.0800000000000001 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.46 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 4.8200000000000003 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' N ' ' A' ' 1' ' ' MET . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.9800000000000004 111.225 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.25 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 23' ' ' ARG . . . . . 0.438 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 2.8799999999999999 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.0999999999999996 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 25' ' ' THR . . . . . 0.459 ' OG1' ' HE2' ' A' ' 2' ' ' LYS . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 3.73 110.466 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 2.9700000000000002 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 2.79 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 28' ' ' ILE . . . . . 0.401 HG22 ' HE1' ' D' ' 48' ' ' TYR . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.1499999999999999 110.436 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.46 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.569 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.3999999999999999 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 3.4399999999999999 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.6600000000000001 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.523 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.1099999999999999 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.3399999999999999 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.3300000000000001 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 37' ' ' TYR . . . . . 0.452 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.2400000000000002 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.1400000000000001 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 1.99 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.7599999999999998 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.3500000000000001 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.3399999999999999 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 1.99 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 44' ' ' ILE . . . . . 0.452 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.0 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 2.77 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.3599999999999999 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 2.9900000000000002 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.418 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.2599999999999998 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.0300000000000002 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 50' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.73 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.6200000000000001 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 52' ' ' MET . . . . . 0.439 ' HG3' ' H ' ' D' ' 54' ' ' CYS . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.29 110.462 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 5.8300000000000001 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 54' ' ' CYS . . . . . 0.439 ' H ' ' HG3' ' D' ' 52' ' ' MET . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 4.5199999999999996 111.373 -179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.0 111.873 178.394 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.705 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O4'-C1'-C2' 107.113 0.921 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.705 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 N19-C1'-C2' 117.664 2.165 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.742 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O3'-P-O5' 100.984 -1.587 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.742 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.767 2.458 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.533 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.342 1.927 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.688 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O3'-P-O5' 100.678 -1.748 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.688 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 O4'-C1'-N19 109.807 2.508 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.517 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-N19 109.149 1.686 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.657 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.466 0 O3'-P-O5' 99.803 -2.209 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.657 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O3'-P-O5' 100.729 -1.721 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.582 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 109.554 2.192 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.54 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.71 0 O3'-P-O5' 99.62 -2.305 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.611 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O3'-P-O5' 99.667 -2.281 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.611 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.774 0 O4'-C1'-N19 109.707 2.384 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.514 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.682 0 O4'-C1'-N19 109.761 2.452 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.514 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O3'-P-O5' 99.615 -2.308 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.496 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.79 0 O4'-C1'-N19 109.504 2.131 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.628 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.107 0 O4'-C1'-N19 109.756 2.445 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.628 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.805 0 O4'-C1'-N19 109.38 1.975 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.565 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.203 1.754 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C1'-N19 109.604 2.255 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.504 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O4'-C1'-N19 109.687 2.359 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.527 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.845 0 O3'-P-O5' 99.816 -2.202 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.648 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.676 0 N19-C1'-C2' 116.828 1.642 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.648 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 116.448 1.405 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.708 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 104.877 -0.723 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.88 0 N19-C1'-C2' 117.184 1.865 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.649 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 O4'-C1'-N19 110.406 3.258 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.551 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.614 2.268 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.551 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 O4'-C1'-N19 109.777 2.471 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.499 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-N19 109.672 2.34 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.571 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.819 0 O3'-P-O5' 99.693 -2.267 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.591 ' N4 ' HD21 ' C' ' 13' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 O4'-C1'-N19 109.562 2.202 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.479 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.576 2.22 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.512 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 100.114 -2.045 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.512 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-N19 109.577 2.221 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.507 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O3'-P-O5' 99.599 -2.316 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.731 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.424 -0.573 0 O3'-P-O5' 99.861 -2.179 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.731 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 109.796 2.494 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.487 ' H72' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 99.487 -2.375 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.698 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O3'-P-O5' 99.822 -2.199 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.698 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.804 0 O4'-C1'-N19 109.624 2.28 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.479 " H1'" " H5'" ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 109.809 2.511 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.817 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.945 0 N19-C1'-C2' 118.415 2.635 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.817 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.555 2.194 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.698 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C1'-N19 109.771 2.464 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.72 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 100.648 -1.764 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.72 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O3'-P-O5' 100.871 -1.647 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.699 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 O3'-P-O5' 101.291 -1.426 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.417 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 N19-C1'-C2' 116.219 1.262 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.888 0.375 . . . . 9.4199999999999999 110.769 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.58 126.93 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.565 -0.532 . . . . 10.67 109.565 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.41 ' HB3' HG13 ' A' ' 6' ' ' ILE . 69.3 m -89.41 149.99 22.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.299 0.571 . . . . 7.75 112.345 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.62 45.67 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.492 -0.777 . . . . 5.6600000000000001 111.471 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.542 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . 79.91 58.59 2.79 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.506 -0.854 . . . . 3.5699999999999998 111.614 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 3' ' ' SER . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 4.6799999999999997 109.696 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.446 ' CG1' ' HB1' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.27 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.4500000000000002 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 2.8900000000000001 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.558 HG21 HD12 ' B' ' 34' ' ' LEU . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 2.9399999999999999 110.452 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.4400000000000004 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.6099999999999999 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.3499999999999996 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.0899999999999999 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 3.6099999999999999 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.3300000000000001 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.454 HG21 ' OP2' ' F' ' 16' ' ' ' DT' . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.4100000000000001 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.1499999999999999 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.447 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.71 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.572 ' HB ' ' OP1' ' F' ' 15' ' ' ' DT' . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 3.73 111.212 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.3099999999999996 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 3.5800000000000001 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 2.9500000000000002 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 3.8700000000000001 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.0899999999999999 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 ' HD3' ' A' ' 47' ' ' LYS . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.4900000000000002 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.7400000000000002 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.1100000000000003 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 4.9900000000000002 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.1699999999999999 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.1200000000000001 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' HG23 ' B' ' 10' ' ' VAL . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 2.9500000000000002 110.352 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 2.9500000000000002 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HG2' HG12 ' B' ' 7' ' ' VAL . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.5099999999999998 110.634 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.493 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.75 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.525 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.1299999999999999 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.1800000000000002 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.6800000000000002 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.2800000000000002 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.1699999999999999 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 2.9100000000000001 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.2599999999999998 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.1000000000000001 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.512 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.4399999999999999 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.3899999999999997 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.603 ' HD3' HD11 ' A' ' 26' ' ' LEU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.1399999999999997 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.4199999999999999 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 4.54 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.0199999999999996 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 6.6799999999999997 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.4699999999999998 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 5.7699999999999996 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m 65.58 91.65 0.08 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.5499999999999998 111.368 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 . . . . . 0 N--CA 1.466 0.327 0 CA-C-N 115.652 -0.704 . . . . 6.7999999999999998 111.008 179.701 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.3 tpp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 121.737 0.779 . . . . 10.279999999999999 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.43 ' HB3' ' H ' ' B' ' 3' ' ' SER . 40.8 mmtt -82.73 -154.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.167 -0.924 . . . . 9.0299999999999994 110.245 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' SER . . . . . 0.503 ' HA ' HD11 ' B' ' 6' ' ' ILE . 5.5 m -65.63 87.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.392 0.615 . . . . 6.5800000000000001 110.799 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.88 78.57 1.17 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.578 -0.737 . . . . 5.3399999999999999 111.109 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLY . . . . . 0.525 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . 91.62 51.56 2.48 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.509 -0.853 . . . . 4.1100000000000003 112.837 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' B' ' 3' ' ' SER . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.25 111.096 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' GLU . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 3.3199999999999998 110.233 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.4699999999999998 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.432 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.3999999999999999 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.463 HG23 ' HA ' ' A' ' 33' ' ' ALA . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 3.48 110.062 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.5199999999999996 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.8899999999999997 110.166 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 3.8199999999999998 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.7000000000000002 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 3.7799999999999998 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.0 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 2.9100000000000001 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.4399999999999999 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.5699999999999998 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.2800000000000002 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' B' ' 21' ' ' GLU . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.7400000000000002 109.685 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 3.6499999999999999 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 3.98 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 4.7999999999999998 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.4100000000000001 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 4.8499999999999996 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 3.6899999999999999 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.0099999999999998 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.4299999999999997 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.5599999999999996 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.4699999999999998 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.446 ' HB1' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 1.98 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.558 HD12 HG21 ' A' ' 10' ' ' VAL . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.3999999999999999 109.487 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.0 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.5 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.564 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.3899999999999997 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.542 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.6000000000000001 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.7400000000000002 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.3799999999999999 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.446 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 3.7599999999999998 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.3499999999999996 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.4199999999999999 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.564 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 2.6899999999999999 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.3599999999999999 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.21 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 3.6600000000000001 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.2000000000000002 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 3.8100000000000001 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.2000000000000002 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt -112.2 98.7 7.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.1900000000000004 110.621 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -171.07 1.96 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.174 -0.466 . . . . 5.4199999999999999 110.991 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' CYS . . . . . 0.476 ' HB3' ' OXT' ' D' ' 55' ' ' GLN . 37.1 m -77.58 62.47 2.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.652 0.739 . . . . 5.5199999999999996 110.63 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.52 -0.764 . . . . 6.3799999999999999 110.594 -179.619 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.6 ' SD ' ' HD3' ' C' ' 8' ' ' ARG . 3.2 ptt? . . . . . 0 N--CA 1.456 -0.131 0 N-CA-C 109.712 -0.477 . . . . 7.7999999999999998 109.712 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -109.39 157.93 18.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.919 0.39 . . . . 8.5700000000000003 110.605 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 3' ' ' SER . . . . . 0.41 ' OG ' HD11 ' C' ' 22' ' ' LEU . 19.3 m -97.97 43.33 1.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.318 0.58 . . . . 5.0099999999999998 110.883 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.25 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.4700000000000002 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 3.96 110.748 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.414 HG22 ' H ' ' C' ' 7' ' ' VAL . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.5299999999999998 110.486 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 8' ' ' ARG . . . . . 0.6 ' HD3' ' SD ' ' C' ' 1' ' ' MET . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 3.6000000000000001 110.468 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 2.6400000000000001 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 2.7000000000000002 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.5699999999999998 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.3900000000000001 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.1600000000000001 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' OD2' ' D' ' 11' ' ' ASP . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.0499999999999998 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.483 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 2.6400000000000001 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 17' ' ' VAL . . . . . 0.407 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.4399999999999999 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.3399999999999999 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.6600000000000001 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.46 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.1799999999999997 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.41 HD11 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.5299999999999998 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.455 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.2199999999999998 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.04 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.0199999999999996 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.0800000000000001 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.4699999999999998 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 3.6899999999999999 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 30' ' ' GLU . . . . . 0.446 ' HB3' ' H71' ' F' ' 7' ' ' ' DT' . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.5800000000000001 110.267 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 31' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' C' ' 30' ' ' GLU . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.1399999999999997 109.875 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.8199999999999998 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.2599999999999998 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 2.6600000000000001 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.25 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.2400000000000002 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.3999999999999999 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 2.5499999999999998 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.1400000000000001 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 2.96 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.3199999999999998 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 44' ' ' ILE . . . . . 0.584 HG22 HD13 ' D' ' 44' ' ' ILE . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.27 110.845 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.4399999999999999 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.02 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 2.96 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.2000000000000002 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.2400000000000002 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 3.7200000000000002 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.0099999999999998 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 5.6200000000000001 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.1200000000000001 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.3099999999999996 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 1' ' ' MET . . . . . 0.417 ' N ' ' HB2' ' A' ' 21' ' ' GLU . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 3.6899999999999999 110.236 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.5699999999999998 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.6400000000000001 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.4399999999999999 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 5' ' ' GLY . . . . . 0.491 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.9199999999999999 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.4500000000000002 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.6099999999999999 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.684 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.77 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.1499999999999999 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.0800000000000001 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.493 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.5899999999999999 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.0599999999999996 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 4.8399999999999999 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 14' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.4300000000000002 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.489 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.5099999999999998 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.483 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 2.75 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.684 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.3599999999999999 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.0800000000000001 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 19' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.46 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 4.8200000000000003 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.9800000000000004 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 22' ' ' LEU . . . . . 0.427 ' HA ' HD23 ' D' ' 22' ' ' LEU . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.25 110.228 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 23' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 2.8799999999999999 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.0999999999999996 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 3.73 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 2.9700000000000002 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 2.79 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.1499999999999999 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.46 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.475 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.3999999999999999 111.121 -179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 3.4399999999999999 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.6600000000000001 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 33' ' ' ALA . . . . . 0.58 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.2999999999999998 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.414 ' CD2' ' HA ' ' D' ' 47' ' ' LYS . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.1099999999999999 109.739 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.3399999999999999 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 36' ' ' ILE . . . . . 0.407 HG12 HD12 ' D' ' 45' ' ' LEU . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.3300000000000001 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 37' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.2400000000000002 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.1400000000000001 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 1.99 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.7599999999999998 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.3500000000000001 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.3399999999999999 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 1.99 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 44' ' ' ILE . . . . . 0.584 HD13 HG22 ' C' ' 44' ' ' ILE . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.0 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 45' ' ' LEU . . . . . 0.407 HD12 HG12 ' D' ' 36' ' ' ILE . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 2.77 110.836 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.459 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.3599999999999999 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 47' ' ' LYS . . . . . 0.414 ' HA ' ' CD2' ' D' ' 34' ' ' LEU . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 2.9900000000000002 110.498 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.2599999999999998 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.0300000000000002 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.73 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.6200000000000001 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.29 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 5.8300000000000001 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 4.5199999999999996 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 55' ' ' GLN . . . . . 0.476 ' OXT' ' HB3' ' B' ' 54' ' ' CYS . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.0 110.512 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.706 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 107.068 0.88 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.706 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 N19-C1'-C2' 117.44 2.025 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.753 H2'' ' N7 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O3'-P-O5' 100.931 -1.615 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.753 ' N7 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 109.731 2.414 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.541 ' H72' " C2'" ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C1'-N19 109.227 1.784 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.656 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O3'-P-O5' 100.378 -1.906 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.656 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 109.716 2.395 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.545 ' C8 ' " H1'" ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.143 1.679 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.714 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.527 0.443 0 O3'-P-O5' 100.141 -2.031 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.714 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 O4'-C1'-N19 109.568 2.21 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.575 ' C8 ' " H1'" ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.76 0 O4'-C1'-N19 109.504 2.13 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.537 ' C6 ' H2'' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.613 -2.309 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.661 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.864 0 O3'-P-O5' 99.544 -2.345 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.661 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.691 0 O4'-C1'-N19 109.386 1.982 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.529 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.688 0 O4'-C1'-N19 109.905 2.631 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.569 " H1'" ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 99.88 -2.169 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.672 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.675 0 O3'-P-O5' 99.854 -2.182 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.672 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.963 0 O4'-C1'-N19 109.835 2.544 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.477 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.921 0 O4'-C1'-N19 109.345 1.931 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.475 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.5 2.125 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.523 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.421 2.027 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.523 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.923 0 O4'-C1'-N19 109.663 2.329 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.51 H2'' ' C6 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.676 0 O3'-P-O5' 99.449 -2.395 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.7 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.618 0 N19-C1'-C2' 117.317 1.948 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.7 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.595 -1.002 0 N19-C1'-C2' 116.269 1.293 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.731 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O5'-C5'-C4' 111.589 0.992 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.731 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.954 0 N19-C1'-C2' 116.976 1.735 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.629 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 110.224 3.03 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.518 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.587 2.234 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.537 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C1'-N19 110.039 2.798 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.537 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 109.936 2.67 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.482 ' H72' " C2'" ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O3'-P-O5' 99.447 -2.396 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.608 H2'' ' C5 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.477 0 O3'-P-O5' 100.145 -2.029 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.608 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.055 2.818 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.447 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.51 2.138 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.407 H2'' ' C6 ' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.798 0 O3'-P-O5' 99.924 -2.145 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.634 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.78 0 O3'-P-O5' 99.951 -2.131 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.811 2.514 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.617 H2'' ' C7 ' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.418 -1.002 0 O3'-P-O5' 99.214 -2.519 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.617 ' C7 ' H2'' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 110.048 2.81 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.737 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.931 0 N19-C1'-C2' 118.168 2.48 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.737 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.425 3.282 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.433 ' H72' " C2'" ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.684 0 O3'-P-O5' 99.057 -2.602 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.927 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.999 0 N19-C1'-C2' 118.093 2.433 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.927 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 109.332 1.915 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.695 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.484 2.106 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.703 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.679 0 O3'-P-O5' 100.233 -1.983 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.703 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.159 1.85 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.64 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.711 0 O4'-C4'-C3' 104.444 -1.156 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 N19-C1'-C2' 116.523 1.452 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.818 0.342 . . . . 9.4199999999999999 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -106.22 167.98 9.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.178 0.513 . . . . 10.67 111.458 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.4 2.88 3.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.233 -0.894 . . . . 7.75 112.108 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -20.0 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.041 0.448 . . . . 5.6600000000000001 110.884 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . 105.5 139.11 9.6 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.759 -0.734 . . . . 3.5699999999999998 112.473 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 4.6799999999999997 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG21 ' SD ' ' B' ' 52' ' ' MET . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.27 109.905 179.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.4500000000000002 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 2.8900000000000001 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 2.9399999999999999 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.4400000000000004 110.527 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.6099999999999999 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.557 HD11 ' C5 ' ' F' ' 17' ' ' ' DG' . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.3499999999999996 110.785 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.0899999999999999 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 3.6099999999999999 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.3300000000000001 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.4100000000000001 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.71 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 3.73 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.3099999999999996 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 3.5800000000000001 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 2.9500000000000002 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 3.8700000000000001 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.0899999999999999 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.4900000000000002 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.7400000000000002 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.1100000000000003 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 4.9900000000000002 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' O ' HG21 ' B' ' 10' ' ' VAL . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.1699999999999999 111.32 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.52 ' HA ' HG11 ' B' ' 10' ' ' VAL . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.1200000000000001 110.965 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 2.9500000000000002 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 2.9500000000000002 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HG2' HG22 ' B' ' 7' ' ' VAL . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.5099999999999998 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.75 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.1299999999999999 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.1800000000000002 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.6800000000000002 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.2800000000000002 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.1699999999999999 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 2.9100000000000001 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.2599999999999998 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.1000000000000001 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.417 HD21 HG11 ' B' ' 16' ' ' VAL . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.4399999999999999 111.058 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.3899999999999997 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.1399999999999997 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.4199999999999999 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 4.54 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.0199999999999996 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 6.6799999999999997 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.4699999999999998 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 5.7699999999999996 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t -77.78 99.26 5.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.5499999999999998 110.102 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.712 -0.676 . . . . 6.7999999999999998 111.443 -179.343 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mmm . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.095 0.474 . . . . 10.279999999999999 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 96.14 4.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.008 -0.542 . . . . 9.0299999999999994 110.599 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.77 88.7 4.01 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.017 -0.538 . . . . 6.5800000000000001 111.318 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -89.98 95.34 10.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.244 0.545 . . . . 5.3399999999999999 110.723 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.26 50.98 2.86 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.25 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.646 HG22 ' HG2' ' A' ' 35' ' ' GLU . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 3.3199999999999998 109.699 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' B' ' 8' ' ' ARG . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.4699999999999998 110.952 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' B' ' 10' ' ' VAL . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.3999999999999999 110.673 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 31' ' ' LYS . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 3.48 111.361 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.5199999999999996 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.8899999999999997 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.476 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 3.8199999999999998 109.92 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.7000000000000002 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.471 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 3.7799999999999998 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.0 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.464 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 2.9100000000000001 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.4399999999999999 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.5699999999999998 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.5 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.2800000000000002 111.722 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.7400000000000002 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 3.6499999999999999 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 3.98 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 4.7999999999999998 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.4100000000000001 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.439 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 4.8499999999999996 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLY . . . . . 0.439 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 3.6899999999999999 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ILE . . . . . 0.486 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.0099999999999998 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.4299999999999997 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.5599999999999996 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.4699999999999998 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.486 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 1.98 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.3999999999999999 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.0 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.522 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.5 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.3899999999999997 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.6000000000000001 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.7400000000000002 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.3799999999999999 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 3.7599999999999998 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.3499999999999996 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.4199999999999999 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 2.6899999999999999 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.3599999999999999 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.21 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 3.6600000000000001 111.156 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.2000000000000002 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.0999999999999996 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 3.8100000000000001 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.2000000000000002 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' MET . . . . . 0.408 ' SD ' HG21 ' A' ' 7' ' ' VAL . 85.5 mmm -85.68 -176.22 5.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.1900000000000004 110.384 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.77 142.63 55.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.058 0.456 . . . . 5.4199999999999999 111.753 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 62.8 m -87.13 162.46 17.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.826 -0.625 . . . . 5.5199999999999996 110.326 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.766 -0.197 . . . . 6.3799999999999999 110.676 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 58.0 mtp . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.216 0.531 . . . . 7.7999999999999998 110.42 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -132.49 29.13 4.27 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.666 -0.697 . . . . 8.5700000000000003 109.414 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -24.09 67.58 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.696 -0.684 . . . . 5.0099999999999998 111.606 -178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 4' ' ' THR . . . . . 0.446 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.25 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 3.96 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.5299999999999998 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 3.6000000000000001 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 2.6400000000000001 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.502 HG13 HG22 ' C' ' 16' ' ' VAL . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 2.7000000000000002 108.696 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.5699999999999998 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.521 ' HA ' ' H73' ' E' ' 16' ' ' ' DT' . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.3900000000000001 109.909 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.1600000000000001 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.419 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.0499999999999998 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.502 HG22 HG13 ' C' ' 10' ' ' VAL . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 2.6400000000000001 109.858 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.4399999999999999 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.414 HG13 ' HD2' ' C' ' 19' ' ' PRO . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.3399999999999999 109.792 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 19' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' C' ' 18' ' ' ILE . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.6600000000000001 110.919 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.46 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.1799999999999997 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.5299999999999998 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.463 ' HD2' HD11 ' C' ' 28' ' ' ILE . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.2199999999999998 109.851 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.04 110.583 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.0199999999999996 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.0800000000000001 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 28' ' ' ILE . . . . . 0.463 HD11 ' HD2' ' C' ' 23' ' ' ARG . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.4699999999999998 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 3.6899999999999999 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.5800000000000001 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.1399999999999997 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 32' ' ' ASP . . . . . 0.512 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.8199999999999998 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.2599999999999998 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 2.6600000000000001 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.25 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.2400000000000002 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.3999999999999999 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 38' ' ' VAL . . . . . 0.475 HG13 ' CB ' ' D' ' 3' ' ' SER . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 2.5499999999999998 111.767 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.1400000000000001 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 2.96 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.3199999999999998 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.27 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.4399999999999999 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.02 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 2.96 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.2000000000000002 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.2400000000000002 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 3.7200000000000002 109.37 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.0099999999999998 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 5.6200000000000001 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.1200000000000001 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.3099999999999996 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 3.6899999999999999 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.5699999999999998 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.6400000000000001 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.4399999999999999 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.9199999999999999 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.4500000000000002 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.6099999999999999 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.567 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.77 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 9' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.1499999999999999 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.536 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.0800000000000001 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.5899999999999999 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.419 ' CD ' HH12 ' C' ' 15' ' ' ARG . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.0599999999999996 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 4.8399999999999999 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 14' ' ' GLY . . . . . 0.536 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.4300000000000002 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.5099999999999998 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 2.75 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.3599999999999999 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.0800000000000001 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.46 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 20' ' ' ILE . . . . . 0.451 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 4.8200000000000003 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 21' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.9800000000000004 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 22' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.25 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 2.8799999999999999 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.0999999999999996 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 3.73 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 2.9700000000000002 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 2.79 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 28' ' ' ILE . . . . . 0.432 HG22 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.1499999999999999 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.46 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.3999999999999999 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 3.4399999999999999 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.6600000000000001 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.2999999999999998 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.481 HD12 HG11 ' C' ' 16' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.1099999999999999 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.3399999999999999 108.302 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.3300000000000001 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 37' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.2400000000000002 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.1400000000000001 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 1.99 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.7599999999999998 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.3500000000000001 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.3399999999999999 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 1.99 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.0 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 2.77 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.3599999999999999 111.167 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 2.9900000000000002 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.432 ' CE1' HG22 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.2599999999999998 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.0300000000000002 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.73 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.6200000000000001 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.29 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 5.8300000000000001 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 4.5199999999999996 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.0 111.145 179.78 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.701 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.701 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.627 2.142 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.688 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-N19 109.343 1.929 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-N19 109.469 2.086 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.53 ' H72' " C2'" ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.445 2.056 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.706 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 100.219 -1.99 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.706 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 109.624 2.28 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.525 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-N19 109.091 1.613 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.662 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.601 -0.482 0 O4'-C1'-N19 109.563 2.203 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.662 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.516 2.145 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.471 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 109.758 2.448 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.598 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 O4'-C1'-N19 109.761 2.451 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.598 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C1'-N19 109.607 2.259 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.595 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.614 2.268 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.542 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 110.031 2.788 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.542 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.639 0 O4'-C1'-N19 109.624 2.28 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.514 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O4'-C1'-N19 109.385 1.981 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.581 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.633 0 O4'-C1'-N19 109.734 2.417 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.581 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C1'-N19 109.425 2.032 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.445 2.057 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.502 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 O4'-C1'-N19 109.46 2.075 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.502 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.783 2.478 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.546 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 O3'-P-O5' 99.768 -2.227 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.623 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O3'-P-O5' 100.838 -1.664 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.623 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.9 0 N19-C1'-C2' 116.419 1.387 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.74 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O5'-C5'-C4' 111.362 0.83 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.74 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.621 1.143 0 N19-C1'-C2' 116.68 1.55 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.586 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 110.212 3.015 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.562 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.094 0 O3'-P-O5' 99.471 -2.383 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.562 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 109.605 2.257 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.514 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O3'-P-O5' 99.404 -2.419 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.538 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O3'-P-O5' 99.508 -2.364 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.56 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O3'-P-O5' 99.704 -2.261 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 O4'-C1'-N19 109.591 2.239 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.526 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.757 2.446 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.466 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.927 -2.144 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.466 ' H72' " C2'" ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.697 2.372 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.635 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.857 -2.18 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.635 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.859 0 O4'-C1'-N19 109.921 2.652 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.523 ' H72' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C1'-N19 109.64 2.3 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.732 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O3'-P-O5' 99.401 -2.42 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.732 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.873 0 O4'-C1'-N19 109.721 2.401 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.44 ' C6 ' H2'' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.865 0 O3'-P-O5' 99.261 -2.494 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.889 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.074 0 N19-C1'-C2' 118.004 2.377 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.889 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-N19 109.453 2.066 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 109.422 2.028 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.596 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-N19 109.312 1.89 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.623 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O3'-P-O5' 100.494 -1.845 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.623 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 101.312 -1.415 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.445 ' C5 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 116.225 1.266 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 tpt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.151 -0.314 . . . . 9.4199999999999999 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -92.27 -9.81 40.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 10.67 111.107 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 m -67.34 111.21 3.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.244 -0.435 . . . . 7.75 110.474 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m -93.51 -36.37 12.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.065 -0.516 . . . . 5.6600000000000001 111.329 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.53 105.93 2.95 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.832 -0.699 . . . . 3.5699999999999998 111.396 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 4.6799999999999997 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.27 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.4500000000000002 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 2.9399999999999999 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.4400000000000004 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.693 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.6099999999999999 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.55 HD22 HH12 ' A' ' 15' ' ' ARG . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.3499999999999996 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.0899999999999999 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.55 HH12 HD22 ' A' ' 13' ' ' LEU . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 3.6099999999999999 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.3300000000000001 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.519 HG21 ' H71' ' F' ' 16' ' ' ' DT' . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.4100000000000001 110.182 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.1499999999999999 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.513 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.71 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.42 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 3.73 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.3099999999999996 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 3.5800000000000001 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 2.9500000000000002 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 3.8700000000000001 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.0899999999999999 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.4900000000000002 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.7400000000000002 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.1100000000000003 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 4.9900000000000002 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.1699999999999999 110.932 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.1200000000000001 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 2.9500000000000002 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' HG22 ' B' ' 10' ' ' VAL . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 2.9500000000000002 111.251 -179.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.5099999999999998 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.466 ' HB ' HG23 ' B' ' 6' ' ' ILE . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.75 110.322 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.1299999999999999 111.155 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.1800000000000002 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.6800000000000002 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.2800000000000002 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.1699999999999999 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 2.9100000000000001 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.2599999999999998 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.1000000000000001 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.407 HD11 ' HB3' ' A' ' 34' ' ' LEU . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.4399999999999999 109.253 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.3899999999999997 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.1399999999999997 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.4199999999999999 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 4.54 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.0199999999999996 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 6.6799999999999997 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.4699999999999998 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 5.7699999999999996 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m -115.72 12.8 16.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.5499999999999998 109.997 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 C--O 1.237 0.403 0 CA-C-N 115.689 -0.687 . . . . 6.7999999999999998 110.334 -179.939 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.182 0.515 . . . . 10.279999999999999 110.225 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -95.93 61.27 2.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.671 -0.695 . . . . 9.0299999999999994 110.088 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.49 101.13 0.56 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.713 -0.676 . . . . 6.5800000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.1 57.34 1.75 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 5.3399999999999999 110.992 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.45 159.68 28.16 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.711 -0.757 . . . . 4.1100000000000003 112.122 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.466 HG23 ' HB ' ' A' ' 36' ' ' ILE . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.25 110.204 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.552 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 3.3199999999999998 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.4699999999999998 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.3999999999999999 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.421 HG22 ' HG ' ' A' ' 34' ' ' LEU . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 3.48 110.093 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.5199999999999996 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.8899999999999997 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 3.8199999999999998 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLY . . . . . 0.475 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.7000000000000002 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.475 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 3.7799999999999998 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.0 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.451 HG12 ' HB3' ' A' ' 15' ' ' ARG . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 2.9100000000000001 111.618 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 43' ' ' ILE . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.4399999999999999 110.048 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.5699999999999998 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.439 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.2800000000000002 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.7400000000000002 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 3.6499999999999999 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.493 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 3.98 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.439 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 4.7999999999999998 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.4100000000000001 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 4.8499999999999996 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 3.6899999999999999 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.0099999999999998 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.4299999999999997 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.5599999999999996 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.4699999999999998 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.3999999999999999 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.0 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.423 HG22 ' HG ' ' B' ' 45' ' ' LEU . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.5 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.3899999999999997 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.6000000000000001 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.428 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.7400000000000002 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.3799999999999999 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 3.7599999999999998 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.3499999999999996 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.4199999999999999 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 2.6899999999999999 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.507 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.3599999999999999 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.21 110.866 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 3.6600000000000001 110.356 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.2000000000000002 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.0999999999999996 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 3.8100000000000001 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.2000000000000002 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt -79.92 57.03 2.49 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.1900000000000004 110.881 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -38.49 74.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.767 -0.652 . . . . 5.4199999999999999 111.12 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -161.95 74.5 0.44 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.026 -0.534 . . . . 5.5199999999999996 110.78 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.162 -0.472 . . . . 6.3799999999999999 110.666 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 121.16 0.505 . . . . 7.7999999999999998 110.408 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -110.06 111.16 22.35 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.909 -0.587 . . . . 8.5700000000000003 110.787 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -90.57 9.77 28.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.585 -0.734 . . . . 5.0099999999999998 110.921 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.25 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.4700000000000002 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 3.96 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.5299999999999998 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 3.6000000000000001 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 2.6400000000000001 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 2.7000000000000002 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.5699999999999998 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.582 HD21 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.3900000000000001 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.1600000000000001 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.0499999999999998 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 2.6400000000000001 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.4399999999999999 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.3399999999999999 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.6600000000000001 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' ILE . . . . . 0.539 ' HA ' ' OP1' ' F' ' 5' ' ' ' DT' . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.46 111.03 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.1799999999999997 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' C' ' 22' ' ' LEU . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.5299999999999998 111.433 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.524 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.2199999999999998 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.04 111.418 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.0199999999999996 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.0800000000000001 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.4699999999999998 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 3.6899999999999999 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.5800000000000001 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.1399999999999997 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.8199999999999998 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 33' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.2599999999999998 110.554 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 2.6600000000000001 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.25 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.2400000000000002 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.3999999999999999 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 2.5499999999999998 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 39' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.1400000000000001 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 42' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 2.96 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 43' ' ' ILE . . . . . 0.468 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.3199999999999998 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.27 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.4399999999999999 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.02 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 2.96 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.2000000000000002 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.2400000000000002 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 3.7200000000000002 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.0099999999999998 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 5.6200000000000001 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.1200000000000001 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.3099999999999996 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 3.6899999999999999 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.5699999999999998 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.41 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.6400000000000001 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.4399999999999999 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.9199999999999999 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.4500000000000002 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' HB1' ' C' ' 33' ' ' ALA . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.6099999999999999 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.77 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.1499999999999999 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.544 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.5899999999999999 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.0599999999999996 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.544 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 4.8399999999999999 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 14' ' ' GLY . . . . . 0.524 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.4300000000000002 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.582 HH11 HD21 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.5099999999999998 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.617 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 2.75 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.492 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.3599999999999999 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.0800000000000001 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.46 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 4.8200000000000003 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.9800000000000004 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 22' ' ' LEU . . . . . 0.41 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.25 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 23' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 2.8799999999999999 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.0999999999999996 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 3.73 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 2.9700000000000002 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 2.79 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 28' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.1499999999999999 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 29' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.46 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.3999999999999999 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 31' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 3.4399999999999999 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.6600000000000001 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.2999999999999998 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.478 ' HB3' HD11 ' D' ' 45' ' ' LEU . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1099999999999999 110.261 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.3399999999999999 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.3300000000000001 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.2400000000000002 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.1400000000000001 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.63 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.7599999999999998 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.3500000000000001 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.3399999999999999 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 1.99 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.0 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 45' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' D' ' 34' ' ' LEU . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 2.77 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.3599999999999999 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 2.9900000000000002 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.2599999999999998 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.0300000000000002 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.73 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.6200000000000001 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.29 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 5.8300000000000001 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 4.5199999999999996 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.0 110.041 -179.055 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.686 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 106.992 0.811 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.731 H2'' ' N7 ' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 N19-C1'-C2' 116.915 1.697 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.731 ' N7 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 O4'-C1'-N19 109.347 1.934 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.701 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.207 1.758 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.737 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 109.173 1.716 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.737 ' C5 ' H2'' ' E' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 117.319 1.949 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.59 ' C8 ' " H1'" ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O4'-C1'-N19 109.328 1.91 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.539 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-N19 109.597 2.246 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.69 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.877 -2.17 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.69 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C1'-N19 109.201 1.752 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.573 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.574 2.218 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.573 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.77 0 O4'-C1'-N19 109.656 2.32 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.576 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.664 0 O3'-P-O5' 99.566 -2.334 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.576 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.688 0 O4'-C1'-N19 109.685 2.356 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.546 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.777 0 O4'-C1'-N19 109.72 2.4 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.546 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.738 0 O4'-C1'-N19 109.555 2.193 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.47 ' C8 ' " H1'" ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-N19 109.913 2.641 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.517 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.695 0 O4'-C1'-N19 109.675 2.344 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.599 -0.68 0 O4'-C1'-N19 109.673 2.341 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.584 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.728 0 O3'-P-O5' 100.029 -2.09 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.584 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.595 2.244 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.431 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O3'-P-O5' 99.821 -2.2 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.567 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.663 0 O4'-C1'-N19 109.761 2.451 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.775 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.765 0 O3'-P-O5' 100.486 -1.849 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.775 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.776 0 N19-C1'-C2' 116.087 1.18 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.708 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.595 0 O4'-C1'-N19 108.67 1.088 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.666 0 N19-C1'-C2' 116.844 1.652 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.629 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 O4'-C1'-N19 110.252 3.065 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.457 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-N19 109.943 2.679 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.539 ' OP1' ' HA ' ' C' ' 20' ' ' ILE . . . . . . . . 0 O5'--C5' 1.431 -0.531 0 O3'-P-O5' 99.867 -2.175 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.806 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-N19 109.716 2.395 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.806 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O3'-P-O5' 99.894 -2.161 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.48 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 100.05 -2.079 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.466 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.841 2.551 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.554 " H1'" ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.548 -2.343 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.554 ' C8 ' " H1'" ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-N19 109.684 2.355 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.52 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-N19 109.706 2.382 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.765 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 O3'-P-O5' 99.933 -2.141 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.765 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.984 2.73 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.501 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O3'-P-O5' 99.417 -2.412 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.572 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.825 0 O3'-P-O5' 99.687 -2.27 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.572 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O4'-C1'-N19 109.676 2.345 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.566 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.421 -0.766 0 O3'-P-O5' 99.164 -2.545 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.566 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.757 0 O3'-P-O5' 99.016 -2.623 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.855 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 100.022 -2.094 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.855 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.176 0 O4'-C1'-N19 109.949 2.687 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.488 H2'' ' C6 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O3'-P-O5' 100.404 -1.893 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.883 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.528 0.529 0 N19-C1'-C2' 117.389 1.993 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.883 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 104.432 -1.168 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.511 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 116.561 1.476 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 110.14 -0.318 . . . . 9.4199999999999999 110.14 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -99.46 104.8 16.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.228 0.537 . . . . 10.67 111.249 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 m -112.99 148.31 35.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.471 -0.786 . . . . 7.75 109.036 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.04 -97.2 0.13 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.913 0.338 . . . . 5.6600000000000001 111.913 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -125.97 118.79 3.26 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.597 -0.811 . . . . 3.5699999999999998 112.362 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 4.6799999999999997 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.27 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.4500000000000002 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 2.8900000000000001 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.409 HG22 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 2.9399999999999999 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.4400000000000004 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.6099999999999999 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' CD1' ' H71' ' F' ' 18' ' ' ' DT' . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.3499999999999996 111.499 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.0899999999999999 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' HG3' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 3.6099999999999999 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.603 HG13 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.3300000000000001 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.4100000000000001 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.1499999999999999 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.71 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 3.73 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.3099999999999996 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 3.5800000000000001 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 2.9500000000000002 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 3.8700000000000001 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.0899999999999999 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.4900000000000002 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.7400000000000002 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.1100000000000003 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 4.9900000000000002 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.1699999999999999 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' B' ' 10' ' ' VAL . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.1200000000000001 110.208 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 2.9500000000000002 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 2.9500000000000002 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.5099999999999998 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.75 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.1299999999999999 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.1800000000000002 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.6800000000000002 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.2800000000000002 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.512 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.1699999999999999 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.512 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 2.9100000000000001 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.437 ' HB ' ' HB3' ' B' ' 45' ' ' LEU . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.2599999999999998 108.807 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.433 HG22 ' HG3' ' A' ' 46' ' ' LYS . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.1000000000000001 111.33 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.4399999999999999 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 44' ' ' ILE . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.3899999999999997 109.872 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.1399999999999997 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.58 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.4199999999999999 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 4.54 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.0199999999999996 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 6.6799999999999997 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.4699999999999998 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.555 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 5.7699999999999996 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m -86.58 95.95 9.93 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.5499999999999998 109.845 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.04 -0.527 . . . . 6.7999999999999998 110.381 -179.741 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.572 0.225 . . . . 10.279999999999999 110.452 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.423 ' H ' ' HG2' ' B' ' 21' ' ' GLU . 5.6 ptpt -154.37 152.85 30.69 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.303 -0.408 . . . . 9.0299999999999994 110.143 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 7.3 m -121.48 15.65 11.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.13 0.491 . . . . 6.5800000000000001 110.143 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.28 -179.2 6.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.51 -0.768 . . . . 5.3399999999999999 110.926 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.85 126.69 17.96 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.683 -0.77 . . . . 4.1100000000000003 111.272 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.25 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 3.3199999999999998 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.4699999999999998 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.3999999999999999 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.424 HG21 ' HA ' ' A' ' 31' ' ' LYS . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 3.48 109.542 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.5199999999999996 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.8899999999999997 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.41 HD11 ' H62' ' E' ' 10' ' ' ' DA' . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 3.8199999999999998 109.802 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.7000000000000002 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 3.7799999999999998 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.0 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 15' ' ' ARG . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 2.9100000000000001 111.531 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.44 HG23 ' HD2' ' B' ' 19' ' ' PRO . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.4399999999999999 109.172 178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG23 ' B' ' 18' ' ' ILE . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.5699999999999998 113.109 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.2800000000000002 112.625 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' B' ' 2' ' ' LYS . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.7400000000000002 111.872 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 3.6499999999999999 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.403 ' HA ' ' HA2' ' B' ' 27' ' ' GLY . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 3.98 111.146 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 4.7999999999999998 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.4100000000000001 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 4.8499999999999996 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' B' ' 23' ' ' ARG . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 3.6899999999999999 111.268 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ILE . . . . . 0.414 HD11 HG21 ' B' ' 18' ' ' ILE . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.0099999999999998 111.406 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.4299999999999997 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.5599999999999996 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.4699999999999998 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.409 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 1.98 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.3999999999999999 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.0 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.5 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.3899999999999997 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.6000000000000001 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.7400000000000002 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.3799999999999999 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 3.7599999999999998 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.3499999999999996 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.4199999999999999 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 2.6899999999999999 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' ILE . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.3599999999999999 109.787 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.21 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 3.6600000000000001 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.2000000000000002 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.0999999999999996 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 3.8100000000000001 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' B' ' 52' ' ' MET . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.2000000000000002 111.422 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' MET . . . . . 0.443 ' H ' ' HB3' ' B' ' 51' ' ' ASN . 0.0 OUTLIER -148.42 127.41 12.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.1900000000000004 110.289 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.21 153.96 39.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.841 0.353 . . . . 5.4199999999999999 111.027 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.46 145.44 41.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 5.5199999999999996 110.875 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.557 -0.292 . . . . 6.3799999999999999 110.382 179.748 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 CA--C 1.517 -0.314 0 CA-C-O 120.795 0.331 . . . . 7.7999999999999998 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -67.22 143.02 56.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.763 -0.653 . . . . 8.5700000000000003 109.947 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 3' ' ' SER . . . . . 0.512 ' HA ' HD11 ' C' ' 6' ' ' ILE . 4.2 m -130.08 39.14 3.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.414 0.626 . . . . 5.0099999999999998 110.038 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.25 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.4700000000000002 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' C' ' 3' ' ' SER . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 3.96 110.054 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.5299999999999998 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 3.6000000000000001 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 2.6400000000000001 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 2.7000000000000002 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.5699999999999998 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' GLU . . . . . 0.459 ' HB2' ' H73' ' F' ' 7' ' ' ' DT' . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' C' ' 13' ' ' LEU . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.3900000000000001 110.95 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.1600000000000001 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.0499999999999998 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 2.6400000000000001 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 17' ' ' VAL . . . . . 0.776 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.4399999999999999 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.46 ' H ' HD12 ' C' ' 18' ' ' ILE . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.3399999999999999 109.602 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.6600000000000001 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' ILE . . . . . 0.444 ' H ' HD12 ' C' ' 20' ' ' ILE . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.46 111.421 -179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.1799999999999997 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.62 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.5299999999999998 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.435 HH12 H5'' ' F' ' 4' ' ' ' DG' . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.2199999999999998 110.818 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.04 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.0199999999999996 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.0800000000000001 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.4699999999999998 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 3.6899999999999999 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.5800000000000001 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 31' ' ' LYS . . . . . 0.496 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.1399999999999997 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.8199999999999998 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' ALA . . . . . 0.543 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.2599999999999998 110.899 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 2.6600000000000001 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.689 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.25 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.2400000000000002 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.3999999999999999 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 2.5499999999999998 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 41' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.1400000000000001 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 2.96 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 43' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.3199999999999998 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.27 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.02 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 2.96 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.2000000000000002 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.2400000000000002 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 3.7200000000000002 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.0099999999999998 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 5.6200000000000001 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 54' ' ' CYS . . . . . 0.555 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.1200000000000001 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.3099999999999996 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 1' ' ' MET . . . . . 0.451 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 3.6899999999999999 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.5699999999999998 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.6400000000000001 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.4399999999999999 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.9199999999999999 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.4500000000000002 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.569 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.6099999999999999 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.451 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.77 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 9' ' ' LYS . . . . . 0.414 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.1499999999999999 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' C' ' 33' ' ' ALA . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.0800000000000001 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.602 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.5899999999999999 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.496 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.0599999999999996 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' D' ' 13' ' ' LEU . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 4.8399999999999999 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.4300000000000002 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.776 ' HA ' HG22 ' C' ' 17' ' ' VAL . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.5099999999999998 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 2.75 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.3599999999999999 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.0800000000000001 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.46 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 20' ' ' ILE . . . . . 0.57 HG21 " H3'" ' E' ' 16' ' ' ' DT' . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 4.8200000000000003 110.522 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.9800000000000004 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.25 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 2.8799999999999999 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.0999999999999996 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 3.73 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 2.9700000000000002 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 2.79 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.1499999999999999 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.46 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.3999999999999999 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 3.4399999999999999 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.6600000000000001 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.2999999999999998 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.1099999999999999 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.3399999999999999 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.3300000000000001 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.2400000000000002 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.1400000000000001 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 1.99 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.7599999999999998 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.3500000000000001 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.3399999999999999 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 43' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 1.99 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 44' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.0 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 2.77 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.435 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.3599999999999999 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 2.9900000000000002 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.2599999999999998 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.0300000000000002 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.73 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.6200000000000001 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.29 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 5.8300000000000001 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 4.5199999999999996 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.0 109.564 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.678 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 108.628 1.034 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.678 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 N19-C1'-C2' 117.058 1.786 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.692 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 O4'-C1'-N19 109.32 1.9 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.692 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.217 1.771 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.564 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O3'-P-O5' 100.636 -1.77 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.604 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O3'-P-O5' 100.478 -1.854 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.604 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C1'-N19 109.363 1.954 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.511 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O3'-P-O5' 100.183 -2.009 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.741 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.669 0 O3'-P-O5' 99.775 -2.223 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.741 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 O4'-C1'-N19 109.489 2.111 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.478 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.476 2.094 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.566 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.647 0 O4'-C1'-N19 109.808 2.51 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.566 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O4'-C1'-N19 109.498 2.122 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.668 2.335 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.465 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.721 2.402 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.654 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.715 0 O3'-P-O5' 99.449 -2.395 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.654 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-N19 109.931 2.664 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.487 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.121 0 O4'-C1'-N19 109.643 2.303 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.574 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.8 0 O3'-P-O5' 100.587 -1.797 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.574 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 O4'-C1'-N19 109.475 2.094 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.644 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C1'-N19 109.382 1.977 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.644 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 110.157 2.946 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.676 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-N19 109.544 2.18 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.698 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 N19-C1'-C2' 116.714 1.571 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 N19-C1'-C2' 115.878 1.049 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.724 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C4'-C3' 104.846 -0.754 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.724 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 N19-C1'-C2' 116.947 1.717 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.622 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 110.167 2.958 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.535 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.954 0 O3'-P-O5' 99.852 -2.183 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.535 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.955 0 O4'-C1'-N19 109.992 2.74 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.56 " C2'" ' H72' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.65 0 O3'-P-O5' 98.925 -2.671 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.56 ' H72' " C2'" ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O4'-C1'-N19 109.729 2.411 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.467 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 99.354 -2.445 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.691 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.779 -2.221 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.691 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O3'-P-O5' 100.372 -1.909 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.495 ' C8 ' " H1'" ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.668 2.335 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.487 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.081 0 O3'-P-O5' 99.254 -2.498 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.718 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.67 0 O3'-P-O5' 99.507 -2.365 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.718 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.061 0 O4'-C1'-N19 109.83 2.538 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.598 ' H71' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.697 0 O3'-P-O5' 99.995 -2.108 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.721 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.951 0 N19-C1'-C2' 118.018 2.386 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.721 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.814 0 O4'-C1'-N19 110.099 2.873 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.463 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O3'-P-O5' 99.483 -2.377 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.713 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.662 0 O3'-P-O5' 99.311 -2.468 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.713 ' C8 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.758 0 O3'-P-O5' 100.183 -2.009 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.653 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.977 0 O4'-C1'-N19 109.59 2.237 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.689 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O3'-P-O5' 100.474 -1.856 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.689 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O3'-P-O5' 100.685 -1.745 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.684 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 101.431 -1.352 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.43 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.447 1.404 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mmm . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.869 0.366 . . . . 9.4199999999999999 110.498 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.44 81.6 7.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.488 . . . . 10.67 110.112 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.0 m -96.57 36.95 1.31 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.952 -0.567 . . . . 7.75 111.274 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.99 50.37 1.86 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.345 0.593 . . . . 5.6600000000000001 109.549 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.33 56.48 0.83 Allowed Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.5699999999999998 110.216 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 4.6799999999999997 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.27 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.4500000000000002 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 2.8900000000000001 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 2.9399999999999999 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.467 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.4400000000000004 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HB2' ' H71' ' F' ' 18' ' ' ' DT' . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.6099999999999999 109.993 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.3499999999999996 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.0899999999999999 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 3.6099999999999999 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.721 HG22 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.3300000000000001 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.4100000000000001 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.1499999999999999 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.608 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.71 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.486 ' HB ' " H4'" ' F' ' 14' ' ' ' DA' . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 3.73 111.277 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.3099999999999996 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 3.5800000000000001 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 2.9500000000000002 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 3.8700000000000001 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.0899999999999999 111.141 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.4900000000000002 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.7400000000000002 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.1100000000000003 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 4.9900000000000002 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.1699999999999999 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.1200000000000001 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 2.9500000000000002 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 45' ' ' LEU . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 2.9500000000000002 110.671 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.5099999999999998 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.75 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.1299999999999999 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.1800000000000002 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.6800000000000002 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.2800000000000002 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.1699999999999999 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 2.9100000000000001 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.2599999999999998 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.1000000000000001 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.4399999999999999 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.3899999999999997 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.1399999999999997 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.4199999999999999 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 4.54 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.574 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.0199999999999996 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 6.6799999999999997 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.4699999999999998 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 5.7699999999999996 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t 65.15 -90.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.5499999999999998 111.216 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.645 0.259 . . . . 6.7999999999999998 110.569 -179.547 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.262 0.553 . . . . 10.279999999999999 109.801 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -73.45 120.68 19.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.499 -0.773 . . . . 9.0299999999999994 109.785 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.8 m -62.52 141.0 58.63 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.157 -0.474 . . . . 6.5800000000000001 111.556 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.64 76.61 4.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.19 0.519 . . . . 5.3399999999999999 110.906 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 149.85 68.7 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.577 -0.738 . . . . 4.1100000000000003 111.345 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.476 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.25 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 3.3199999999999998 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.4699999999999998 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.3999999999999999 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 3.48 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.5199999999999996 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.8899999999999997 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 3.8199999999999998 110.363 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.7000000000000002 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 3.7799999999999998 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.0 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.433 HG11 ' OP2' ' E' ' 7' ' ' ' DG' . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 2.9100000000000001 111.201 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.4399999999999999 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.5699999999999998 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.2800000000000002 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.7400000000000002 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 3.6499999999999999 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 3.98 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 4.7999999999999998 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.4100000000000001 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 4.8499999999999996 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 3.6899999999999999 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.0099999999999998 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.4299999999999997 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.5599999999999996 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.4699999999999998 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 1.98 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.3999999999999999 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.0 110.332 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.5 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.3899999999999997 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.601 HG22 HG23 ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.6000000000000001 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.7400000000000002 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.3799999999999999 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 3.7599999999999998 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.3499999999999996 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.601 HG23 HG22 ' B' ' 38' ' ' VAL . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.4199999999999999 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.659 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.3599999999999999 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.21 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 3.6600000000000001 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.2000000000000002 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.0999999999999996 110.438 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 3.8100000000000001 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.2000000000000002 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt -82.95 155.6 23.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.1900000000000004 110.443 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 4.1 m -67.19 126.09 28.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 5.4199999999999999 111.427 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' D' ' 54' ' ' CYS . 0.0 OUTLIER -69.79 118.51 12.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.425 -0.583 . . . . 5.5199999999999996 109.425 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 116.284 -0.416 . . . . 6.3799999999999999 111.081 -179.03 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 6.5 tpt . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.618 0.247 . . . . 7.7999999999999998 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -144.44 122.11 11.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.008 0.433 . . . . 8.5700000000000003 110.937 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -129.76 113.39 14.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.192 -0.458 . . . . 5.0099999999999998 110.15 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.25 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.4700000000000002 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 3.96 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.5299999999999998 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 8' ' ' ARG . . . . . 0.45 ' HD3' ' OP1' ' F' ' 6' ' ' ' DT' . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 3.6000000000000001 110.104 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 9' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 2.6400000000000001 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 2.7000000000000002 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 11' ' ' ASP . . . . . 0.4 ' HB3' ' N ' ' C' ' 15' ' ' ARG . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.5699999999999998 109.178 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.403 HD23 ' N4 ' ' F' ' 8' ' ' ' DC' . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.3900000000000001 111.652 -178.533 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.1600000000000001 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.0499999999999998 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 2.6400000000000001 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' VAL . . . . . 0.463 HG22 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.4399999999999999 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.3399999999999999 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 19' ' ' PRO . . . . . 0.548 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.6600000000000001 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 20' ' ' ILE . . . . . 0.441 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.46 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.1799999999999997 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.5299999999999998 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.2199999999999998 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ARG . . . . . 0.441 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.04 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 25' ' ' THR . . . . . 0.413 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.0199999999999996 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.0800000000000001 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.4699999999999998 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 3.6899999999999999 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.5800000000000001 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 31' ' ' LYS . . . . . 0.483 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.1399999999999997 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.8199999999999998 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.2599999999999998 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 2.6600000000000001 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.507 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.25 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.2400000000000002 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.3999999999999999 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 38' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' C' ' 43' ' ' ILE . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 2.5499999999999998 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 40' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.1400000000000001 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 2.96 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 43' ' ' ILE . . . . . 0.556 ' HA ' HG12 ' C' ' 38' ' ' VAL . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.3199999999999998 109.801 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.27 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 45' ' ' LEU . . . . . 0.423 ' HB3' HD23 ' C' ' 34' ' ' LEU . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.4399999999999999 109.768 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 46' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.02 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 2.96 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.2000000000000002 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.2400000000000002 109.588 -179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 3.7200000000000002 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.0099999999999998 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 53' ' ' THR . . . . . 0.412 ' O ' ' HB3' ' C' ' 54' ' ' CYS . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 5.6200000000000001 110.034 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 54' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' C' ' 53' ' ' THR . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.1200000000000001 111.437 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.3099999999999996 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 3.6899999999999999 110.253 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.5699999999999998 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.494 ' O ' HG22 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.6400000000000001 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.4399999999999999 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.9199999999999999 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.4500000000000002 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.6099999999999999 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.77 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.1499999999999999 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.0800000000000001 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.5899999999999999 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.0599999999999996 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.512 ' HA ' HD13 ' D' ' 13' ' ' LEU . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 4.8399999999999999 111.386 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.4300000000000002 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.606 ' CZ ' ' H73' ' F' ' 6' ' ' ' DT' . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.5099999999999998 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 2.75 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.543 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.3599999999999999 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.0800000000000001 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 19' ' ' PRO . . . . . 0.564 ' HB3' ' OP1' ' E' ' 16' ' ' ' DT' . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.46 113.745 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 4.8200000000000003 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.9800000000000004 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 22' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.25 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 2.8799999999999999 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.0999999999999996 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 3.73 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 2.9700000000000002 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 2.79 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.1499999999999999 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.46 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.543 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.3999999999999999 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 3.4399999999999999 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 32' ' ' ASP . . . . . 0.44 ' O ' HG23 ' C' ' 10' ' ' VAL . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.6600000000000001 110.509 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 33' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.2999999999999998 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.1099999999999999 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 35' ' ' GLU . . . . . 0.438 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.3399999999999999 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.3300000000000001 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.2400000000000002 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 38' ' ' VAL . . . . . 0.41 ' HB ' HD21 ' C' ' 22' ' ' LEU . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.1400000000000001 110.637 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.631 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 1.99 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.7599999999999998 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.3500000000000001 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.3399999999999999 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 1.99 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.0 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 2.77 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.438 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.3599999999999999 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 2.9900000000000002 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.2599999999999998 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.0300000000000002 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.73 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 51' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.6200000000000001 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 52' ' ' MET . . . . . 0.444 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.29 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 5.8300000000000001 110.619 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 54' ' ' CYS . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 4.5199999999999996 110.626 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.0 109.913 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.709 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.434 -0.368 0 O4'-C1'-N19 108.582 0.978 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.709 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.865 0 N19-C1'-C2' 117.363 1.977 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.708 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O3'-P-O5' 100.695 -1.74 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -0.994 0 O4'-C1'-N19 109.501 2.126 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.634 " C2'" ' H72' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 O4'-C1'-N19 109.481 2.101 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.714 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.579 0 N19-C1'-C2' 117.084 1.803 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.714 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 109.775 2.469 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-N19 109.388 1.984 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.757 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.424 0 O3'-P-O5' 100.057 -2.075 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.757 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O4'-C1'-N19 109.547 2.183 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.54 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-N19 109.438 2.047 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.562 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-N19 109.67 2.337 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.565 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 99.448 -2.396 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.565 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 109.658 2.322 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.537 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-N19 109.708 2.385 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.576 " H1'" ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.72 0 O4'-C1'-N19 109.724 2.405 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.576 ' C8 ' " H1'" ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.855 0 O4'-C1'-N19 109.555 2.193 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.498 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.964 0 O4'-C1'-N19 109.581 2.227 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.606 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.454 0 O4'-C1'-N19 109.193 1.741 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.606 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C1'-N19 109.445 2.056 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.518 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-N19 109.429 2.037 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.518 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.764 2.455 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.62 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.581 0 O3'-P-O5' 99.988 -2.112 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.65 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 100.402 -1.894 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.65 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.846 0 N19-C1'-C2' 116.479 1.425 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.765 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.625 0 O5'-C5'-C4' 111.635 1.025 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.765 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.622 1.212 0 N19-C1'-C2' 116.914 1.696 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.62 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-N19 109.806 2.507 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.472 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.727 0 O4'-C1'-N19 109.709 2.386 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.619 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.623 0 O4'-C1'-N19 109.834 2.543 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.711 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 O4'-C1'-N19 109.593 2.242 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.711 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 O3'-P-O5' 99.105 -2.576 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.485 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.915 0 O3'-P-O5' 98.916 -2.676 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.514 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O4'-C1'-N19 109.599 2.249 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.523 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.562 0 O3'-P-O5' 99.803 -2.209 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.523 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.629 2.286 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.464 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.885 0 O3'-P-O5' 99.51 -2.363 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.786 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.656 0 O3'-P-O5' 99.528 -2.354 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.786 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 110.107 2.884 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.443 " H5'" " H1'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.881 0 O3'-P-O5' 99.379 -2.432 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.744 H2'' ' N7 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.592 -1.218 0 N19-C1'-C2' 117.819 2.262 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.744 ' N7 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.011 0 O4'-C1'-N19 110.479 3.349 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.408 ' H71' ' HB2' ' A' ' 12' ' ' GLU . . . . . . . . 0 O3'--C3' 1.423 -0.649 0 O3'-P-O5' 99.096 -2.581 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.924 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.804 0 N19-C1'-C2' 117.757 2.223 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.924 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 109.638 2.298 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.539 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.64 0 O3'-P-O5' 100.414 -1.887 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.71 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.87 -2.174 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.71 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 N19-C1'-C2' 117.339 1.962 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 O4'-C4'-C3' 104.425 -1.175 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.49 ' H71' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.092 1.182 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.475 0.825 0 N-CA-C 109.937 -0.394 . . . . 9.4199999999999999 109.937 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' A' ' 21' ' ' GLU . 20.8 tptp -64.85 132.13 48.63 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 109.355 -0.609 . . . . 10.67 109.355 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.407 ' O ' HG12 ' B' ' 38' ' ' VAL . 1.0 OUTLIER -92.07 24.1 3.45 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 111.981 0.363 . . . . 7.75 111.981 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 m -102.83 65.18 0.89 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.246 0.546 . . . . 5.6600000000000001 111.9 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.21 68.68 1.45 Allowed Glycine 0 N--CA 1.452 -0.252 0 CA-C-N 115.913 -0.585 . . . . 3.5699999999999998 113.267 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.462 HD12 ' HD2' ' A' ' 8' ' ' ARG . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 4.6799999999999997 110.679 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.27 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.462 ' HD2' HD12 ' A' ' 6' ' ' ILE . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.4500000000000002 109.936 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 2.8900000000000001 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG22 ' H ' ' B' ' 32' ' ' ASP . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 2.9399999999999999 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.4400000000000004 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.6099999999999999 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.3499999999999996 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.0899999999999999 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.69 ' HD2' ' H72' ' E' ' 6' ' ' ' DT' . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 3.6099999999999999 110.383 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.3300000000000001 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.552 HG11 " H2'" ' F' ' 16' ' ' ' DT' . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.4100000000000001 110.927 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.1499999999999999 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.71 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.494 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 3.73 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' HZ3' ' A' ' 2' ' ' LYS . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.3099999999999996 110.452 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 3.5800000000000001 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 2.9500000000000002 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 3.8700000000000001 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.0899999999999999 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.4900000000000002 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.7400000000000002 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.1100000000000003 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 4.9900000000000002 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.1699999999999999 110.614 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.1200000000000001 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 2.9500000000000002 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 2.9500000000000002 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.5099999999999998 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.75 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.1299999999999999 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.1800000000000002 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.6800000000000002 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.2800000000000002 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.1699999999999999 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 2.9100000000000001 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.2599999999999998 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.1000000000000001 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.4399999999999999 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.3899999999999997 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.1399999999999997 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.4199999999999999 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 4.54 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.0199999999999996 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 6.6799999999999997 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.4699999999999998 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 5.7699999999999996 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m 71.41 -63.22 0.43 Allowed 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.5499999999999998 110.12 -178.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.388 . . . . 6.7999999999999998 110.27 179.608 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.4 ptt? . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.67 0.271 . . . . 10.279999999999999 110.667 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttt 56.44 -107.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.642 -0.708 . . . . 9.0299999999999994 110.316 -178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 6.7 m 55.47 39.34 31.08 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.968 0.414 . . . . 6.5800000000000001 111.418 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -87.79 171.69 10.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.248 -0.433 . . . . 5.3399999999999999 110.369 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.69 81.38 1.34 Allowed Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.1100000000000003 111.019 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.25 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 3.3199999999999998 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.4699999999999998 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.3999999999999999 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 3.48 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ASP . . . . . 0.478 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.5199999999999996 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.481 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.8899999999999997 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 3.8199999999999998 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.7000000000000002 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.478 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 3.7799999999999998 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.0 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 2.9100000000000001 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.4399999999999999 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.5699999999999998 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.2800000000000002 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.525 ' HG2' ' OP1' ' E' ' 5' ' ' ' DT' . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.7400000000000002 111.227 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 3.6499999999999999 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 3.98 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 4.7999999999999998 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.4100000000000001 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 4.8499999999999996 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 3.6899999999999999 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.0099999999999998 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.4299999999999997 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.489 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.5599999999999996 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.498 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.4699999999999998 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 1.98 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.3999999999999999 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.0 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.5 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.3899999999999997 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 3' ' ' SER . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.6000000000000001 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.7400000000000002 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.3799999999999999 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 3.7599999999999998 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.3499999999999996 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.4199999999999999 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 2.6899999999999999 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.3599999999999999 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.21 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 3.6600000000000001 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.2000000000000002 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.0999999999999996 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 3.8100000000000001 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.2000000000000002 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm -142.08 18.06 2.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.1900000000000004 109.812 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.71 96.89 3.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.727 -0.67 . . . . 5.4199999999999999 111.688 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 29.7 m 71.5 -44.66 0.6 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.609 0.763 . . . . 5.5199999999999996 112.788 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 120.674 0.273 . . . . 6.3799999999999999 110.67 -179.758 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.151 0.5 . . . . 7.7999999999999998 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -122.86 136.67 54.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.948 -0.569 . . . . 8.5700000000000003 109.912 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -101.98 -74.4 0.63 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.562 -0.29 . . . . 5.0099999999999998 110.591 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.25 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.4700000000000002 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 3.96 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.5299999999999998 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 3.6000000000000001 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 2.6400000000000001 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.567 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 2.7000000000000002 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 11' ' ' ASP . . . . . 0.691 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.5699999999999998 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 12' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.3900000000000001 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' GLY . . . . . 0.585 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.1600000000000001 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.691 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.0499999999999998 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 2.6400000000000001 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.4399999999999999 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.3399999999999999 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.6600000000000001 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.46 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' GLU . . . . . 0.454 ' HG2' ' OP1' ' F' ' 5' ' ' ' DT' . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.1799999999999997 109.537 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.5299999999999998 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.2199999999999998 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.04 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.0199999999999996 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.0800000000000001 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.4699999999999998 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 3.6899999999999999 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.5800000000000001 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.1399999999999997 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.8199999999999998 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.2599999999999998 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 2.6600000000000001 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.25 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.2400000000000002 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 37' ' ' TYR . . . . . 0.418 ' HA ' ' O ' ' D' ' 3' ' ' SER . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.3999999999999999 108.763 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 38' ' ' VAL . . . . . 0.478 HG22 ' HB2' ' D' ' 3' ' ' SER . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 2.5499999999999998 111.883 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 39' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.1400000000000001 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 42' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 2.96 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.3199999999999998 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.27 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.4399999999999999 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 46' ' ' LYS . . . . . 0.483 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.02 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 2.96 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.2000000000000002 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.2400000000000002 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 3.7200000000000002 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.0099999999999998 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 5.6200000000000001 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.1200000000000001 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.3099999999999996 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 3.6899999999999999 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 2' ' ' LYS . . . . . 0.542 ' H ' HD12 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.5699999999999998 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.478 ' HB2' HG22 ' C' ' 38' ' ' VAL . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.6400000000000001 111.87 -178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.4399999999999999 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.9199999999999999 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 6' ' ' ILE . . . . . 0.542 HD12 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.4500000000000002 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.6099999999999999 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.77 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 9' ' ' LYS . . . . . 0.419 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.1499999999999999 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.797 HG13 ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.0800000000000001 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.797 ' H ' HG13 ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.5899999999999999 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.494 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.0599999999999996 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.414 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 4.8399999999999999 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.4300000000000002 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.5099999999999998 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 2.75 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' C' ' 15' ' ' ARG . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.3599999999999999 110.788 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 18' ' ' ILE . . . . . 0.46 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.0800000000000001 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 19' ' ' PRO . . . . . 0.656 ' HA ' ' OP1' ' E' ' 15' ' ' ' DT' . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.46 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 4.8200000000000003 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 21' ' ' GLU . . . . . 0.494 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.9800000000000004 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.25 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 23' ' ' ARG . . . . . 0.585 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 2.8799999999999999 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.0999999999999996 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 3.73 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 2.9700000000000002 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 2.79 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.1499999999999999 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.46 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.505 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.3999999999999999 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 3.4399999999999999 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.6600000000000001 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.2999999999999998 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.471 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.1099999999999999 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.3399999999999999 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.3300000000000001 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.1400000000000001 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 1.99 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.7599999999999998 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.3500000000000001 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.483 ' CB ' ' HB3' ' C' ' 46' ' ' LYS . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.3399999999999999 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.0 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 2.77 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.3599999999999999 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 2.9900000000000002 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.2599999999999998 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.0300000000000002 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 50' ' ' PRO . . . . . 0.408 ' HB2' ' SD ' ' D' ' 52' ' ' MET . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.73 111.258 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.6200000000000001 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 52' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' D' ' 50' ' ' PRO . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.29 110.33 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 5.8300000000000001 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 4.5199999999999996 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.0 110.153 -179.631 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.717 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-N19 108.586 0.983 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.717 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 117.153 1.846 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.705 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.579 2.223 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.652 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-N19 109.198 1.747 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.602 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.394 1.993 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.69 ' H72' ' HD2' ' A' ' 15' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 N19-C1'-C2' 117.229 1.893 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.572 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 100.284 -1.956 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.572 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O3'-P-O5' 100.661 -1.757 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.665 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.535 2.169 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.665 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O3'-P-O5' 100.453 -1.867 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-N19 109.537 2.171 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.569 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O3'-P-O5' 99.721 -2.252 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.591 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O3'-P-O5' 99.993 -2.109 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.591 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.537 2.171 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.656 ' OP1' ' HA ' ' D' ' 19' ' ' PRO . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.988 2.735 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.643 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 O4'-C1'-N19 109.78 2.475 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.643 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 O4'-C1'-N19 109.956 2.695 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.599 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.17 0 O3'-P-O5' 99.64 -2.295 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.599 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.386 1.983 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.623 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.903 0 O3'-P-O5' 100.588 -1.796 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.623 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-N19 109.404 2.006 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.516 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 O4'-C1'-N19 109.76 2.45 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.681 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.651 0 O4'-C1'-N19 109.514 2.143 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.733 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O3'-P-O5' 100.746 -1.713 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.733 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.968 1.105 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.74 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C5'-C4'-O4' 108.221 -0.737 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.74 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 N19-C1'-C2' 117.113 1.82 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.607 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 110.042 2.802 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.427 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.809 0 O4'-C1'-N19 109.944 2.68 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.664 H2'' ' H71' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.797 0 O3'-P-O5' 99.837 -2.191 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.664 ' H71' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-N19 109.681 2.351 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.53 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 O3'-P-O5' 99.471 -2.384 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.53 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.662 0 O3'-P-O5' 99.3 -2.474 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.68 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 100.094 -2.056 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.68 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-N19 110.147 2.933 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.482 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 99.482 -2.378 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.533 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.877 0 O3'-P-O5' 99.809 -2.206 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.787 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.798 0 O3'-P-O5' 99.723 -2.251 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.787 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 O4'-C1'-N19 110.166 2.957 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.698 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.645 0 O3'-P-O5' 99.251 -2.499 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.782 0 O3'-P-O5' 99.682 -2.273 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.589 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O3'-P-O5' 99.432 -2.404 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.58 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.864 0 O3'-P-O5' 99.166 -2.544 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.63 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.418 -0.992 0 O3'-P-O5' 99.068 -2.596 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.695 H2'' ' C8 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.203 0 O3'-P-O5' 99.67 -2.279 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.695 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.2 0 O4'-C1'-N19 109.554 2.192 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.51 ' H72' " H2'" ' F' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.826 0 O3'-P-O5' 100.02 -2.095 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.682 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.742 0 O3'-P-O5' 99.629 -2.3 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.682 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 101.552 -1.289 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . 0.443 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 116.391 1.369 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.598 0.237 . . . . 9.4199999999999999 111.132 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' D' ' 25' ' ' THR . 0.1 OUTLIER -120.48 166.79 13.12 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.281 -0.266 . . . . 10.67 110.281 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -91.7 6.91 44.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.823 0.344 . . . . 7.75 111.27 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.38 78.45 9.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.899 0.38 . . . . 5.6600000000000001 111.259 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.57 57.53 1.84 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.625 -0.797 . . . . 3.5699999999999998 111.978 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 4.6799999999999997 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.27 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.4500000000000002 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 2.8900000000000001 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 2.9399999999999999 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.4400000000000004 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' B' ' 23' ' ' ARG . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.6099999999999999 110.941 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' HB3' ' H73' ' F' ' 16' ' ' ' DT' . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.3499999999999996 110.68 -179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.0899999999999999 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.455 ' HG2' HG22 ' B' ' 17' ' ' VAL . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 3.6099999999999999 112.014 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.541 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.3300000000000001 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.44 ' HA ' ' HG2' ' B' ' 15' ' ' ARG . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.4100000000000001 112.172 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.1499999999999999 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HG2' HG11 ' B' ' 38' ' ' VAL . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.71 112.421 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 3.73 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.3099999999999996 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.429 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 3.5800000000000001 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 2.9500000000000002 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 3.8700000000000001 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.0899999999999999 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.4900000000000002 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.7400000000000002 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.1100000000000003 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 4.9900000000000002 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.1699999999999999 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.1200000000000001 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB1' ' HB ' ' B' ' 7' ' ' VAL . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 2.9500000000000002 111.174 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.426 ' HB2' ' HB3' ' B' ' 8' ' ' ARG . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 2.9500000000000002 109.846 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.5099999999999998 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' B' ' 8' ' ' ARG . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.75 110.629 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.574 ' HA ' ' O ' ' B' ' 4' ' ' THR . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.1299999999999999 109.347 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.1800000000000002 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.406 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.6800000000000002 109.314 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.2800000000000002 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.1699999999999999 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 2.9100000000000001 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' B' ' 45' ' ' LEU . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.2599999999999998 109.84 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.1000000000000001 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.4399999999999999 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.3899999999999997 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HB2' ' HB2' ' B' ' 41' ' ' GLU . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.1399999999999997 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.4199999999999999 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 4.54 110.228 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.0199999999999996 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 6.6799999999999997 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.4699999999999998 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 5.7699999999999996 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -76.93 -33.47 57.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.5499999999999998 110.222 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.71 -0.677 . . . . 6.7999999999999998 109.728 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.911 0.386 . . . . 10.279999999999999 110.62 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -82.14 -21.23 36.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.373 0.606 . . . . 9.0299999999999994 109.891 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 p -147.19 -79.13 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.336 -0.847 . . . . 6.5800000000000001 109.183 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.574 ' O ' ' HA ' ' A' ' 37' ' ' TYR . 0.2 OUTLIER -121.99 -54.95 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.16 -0.473 . . . . 5.3399999999999999 110.081 178.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 144.36 -82.1 0.21 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.507 -0.854 . . . . 4.1100000000000003 112.297 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.25 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.412 ' HB ' ' HB1' ' A' ' 33' ' ' ALA . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 3.3199999999999998 110.868 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.556 ' HB2' HD11 ' A' ' 36' ' ' ILE . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.4699999999999998 109.662 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.3999999999999999 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' VAL . . . . . 0.484 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 3.48 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.5199999999999996 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.8899999999999997 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' B' ' 13' ' ' LEU . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 3.8199999999999998 109.846 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLY . . . . . 0.402 ' HA3' " O5'" ' F' ' 14' ' ' ' DA' . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.7000000000000002 114.105 -178.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.515 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 3.7799999999999998 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.541 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.0 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.455 HG22 ' HG2' ' A' ' 15' ' ' ARG . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 2.9100000000000001 110.841 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.4399999999999999 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' PRO . . . . . 0.471 ' HD2' HG23 ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.5699999999999998 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ILE . . . . . 0.41 ' H ' HG13 ' B' ' 20' ' ' ILE . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.2800000000000002 111.34 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.7400000000000002 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' LEU . . . . . 0.401 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 3.6499999999999999 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.444 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 3.98 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 4.7999999999999998 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.4100000000000001 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 4.8499999999999996 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 3.6899999999999999 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.0099999999999998 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.4299999999999997 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.5599999999999996 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.4699999999999998 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 1.98 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' B' ' 45' ' ' LEU . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.3999999999999999 110.042 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.0 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.5 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.3899999999999997 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.454 HG11 ' HG2' ' A' ' 19' ' ' PRO . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.6000000000000001 110.813 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.446 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.7400000000000002 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.3799999999999999 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 3.7599999999999998 110.554 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.3499999999999996 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.4199999999999999 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 2.6899999999999999 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.419 ' HB3' HD21 ' B' ' 34' ' ' LEU . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.3599999999999999 108.33 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.21 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 3.6600000000000001 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' TYR . . . . . 0.44 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.2000000000000002 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.0999999999999996 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 3.8100000000000001 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.2000000000000002 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp -132.36 -179.41 5.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.1900000000000004 110.454 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.52 155.56 39.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.007 -0.542 . . . . 5.4199999999999999 110.532 179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.4 115.85 15.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.399 -0.364 . . . . 5.5199999999999996 111.238 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 116.214 -0.448 . . . . 6.3799999999999999 110.073 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.32 0.581 . . . . 7.7999999999999998 110.168 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 2' ' ' LYS . . . . . 0.451 ' HG2' ' OG1' ' C' ' 4' ' ' THR . 44.1 tttm -167.05 100.15 0.53 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 8.5700000000000003 109.535 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 46.96 0.35 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.579 0.585 . . . . 5.0099999999999998 112.579 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 4' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' C' ' 2' ' ' LYS . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.25 109.763 179.229 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.4700000000000002 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 3.96 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.5299999999999998 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 3.6000000000000001 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 2.6400000000000001 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 2.7000000000000002 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 11' ' ' ASP . . . . . 0.649 ' HB3' ' OP1' ' F' ' 7' ' ' ' DT' . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.5699999999999998 108.671 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.844 HD11 ' HA ' ' D' ' 20' ' ' ILE . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.3900000000000001 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.1600000000000001 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ARG . . . . . 0.542 HH21 " C4'" ' F' ' 5' ' ' ' DT' . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.0499999999999998 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 16' ' ' VAL . . . . . 0.543 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 2.6400000000000001 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 17' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.4399999999999999 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.3399999999999999 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.6600000000000001 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.46 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.1799999999999997 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' LEU . . . . . 0.665 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.5299999999999998 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.2199999999999998 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.04 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.0199999999999996 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.0800000000000001 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.4699999999999998 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 3.6899999999999999 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.5800000000000001 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.1399999999999997 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.8199999999999998 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.2599999999999998 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 2.6600000000000001 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 35' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.25 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.2400000000000002 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.3999999999999999 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 38' ' ' VAL . . . . . 0.48 HG13 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 2.5499999999999998 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.1400000000000001 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 2.96 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 43' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.3199999999999998 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.27 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.4399999999999999 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.02 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 2.96 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 48' ' ' TYR . . . . . 0.551 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.2000000000000002 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.2400000000000002 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 3.7200000000000002 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.0099999999999998 110.189 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 53' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 5.6200000000000001 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 54' ' ' CYS . . . . . 0.419 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.1200000000000001 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.3099999999999996 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 1' ' ' MET . . . . . 0.431 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 3.6899999999999999 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.5699999999999998 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 3' ' ' SER . . . . . 0.48 ' CB ' HG13 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.6400000000000001 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.4399999999999999 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.9199999999999999 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.4500000000000002 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 7' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.6099999999999999 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 8' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.77 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 9' ' ' LYS . . . . . 0.436 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.1499999999999999 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 10' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.0800000000000001 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 11' ' ' ASP . . . . . 0.407 ' HB2' ' OP1' ' F' ' 5' ' ' ' DT' . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.5899999999999999 109.93 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 12' ' ' GLU . . . . . 0.43 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.0599999999999996 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 13' ' ' LEU . . . . . 0.413 ' HG ' H5'' ' E' ' 25' ' ' ' DT' . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 4.8399999999999999 109.6 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.4300000000000002 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.534 ' HA ' ' HA ' ' C' ' 17' ' ' VAL . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.5099999999999998 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 16' ' ' VAL . . . . . 0.543 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 2.75 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 17' ' ' VAL . . . . . 0.441 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.3599999999999999 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.0800000000000001 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 19' ' ' PRO . . . . . 0.448 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.46 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 20' ' ' ILE . . . . . 0.844 ' HA ' HD11 ' C' ' 13' ' ' LEU . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 4.8200000000000003 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.9800000000000004 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 22' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.25 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 2.8799999999999999 111.682 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 24' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.0999999999999996 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 25' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 3.73 110.296 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 2.9700000000000002 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 2.79 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.1499999999999999 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.46 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 30' ' ' GLU . . . . . 0.554 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.3999999999999999 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 3.4399999999999999 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.6600000000000001 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.1099999999999999 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.3399999999999999 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.3300000000000001 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.2400000000000002 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.1400000000000001 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 1.99 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.7599999999999998 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 41' ' ' GLU . . . . . 0.646 ' HA ' HD22 ' C' ' 26' ' ' LEU . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.3500000000000001 111.382 -179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.3399999999999999 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 1.99 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 45' ' ' LEU . . . . . 0.519 HD23 HG11 ' C' ' 16' ' ' VAL . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 2.77 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.3599999999999999 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 2.9900000000000002 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.2599999999999998 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 49' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.0300000000000002 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 50' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.73 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.6200000000000001 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.29 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 5.8300000000000001 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 4.5199999999999996 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.0 110.197 -179.019 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' E' E ' 1' ' ' ' DA' . . . . . 0.668 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 2' ' ' ' DT' . . . . . 0.668 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 117.089 1.806 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 3' ' ' ' DG' . . . . . 0.769 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 100.788 -1.691 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 4' ' ' ' DA' . . . . . 0.769 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.05 0 O4'-C1'-N19 109.603 2.254 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 5' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.208 1.76 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 6' ' ' ' DT' . . . . . 0.699 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O3'-P-O5' 100.422 -1.883 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 7' ' ' ' DG' . . . . . 0.699 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 109.458 2.073 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 8' ' ' ' DA' . . . . . 0.523 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 O4'-C1'-N19 109.161 1.702 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 9' ' ' ' DC' . . . . . 0.674 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.468 0 O4'-C1'-N19 109.455 2.068 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 10' ' ' ' DA' . . . . . 0.734 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.812 -1.678 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 11' ' ' ' DA' . . . . . 0.734 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C1'-N19 109.7 2.375 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 12' ' ' ' DT' . . . . . 0.533 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.595 2.244 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 13' ' ' ' DT' . . . . . 0.542 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 109.552 2.19 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 14' ' ' ' DA' . . . . . 0.542 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-N19 109.499 2.124 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 15' ' ' ' DT' . . . . . 0.482 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.653 0 O4'-C1'-N19 109.642 2.303 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 16' ' ' ' DT' . . . . . 0.554 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O3'-P-O5' 99.832 -2.194 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 17' ' ' ' DG' . . . . . 0.554 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 109.642 2.302 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 18' ' ' ' DG' . . . . . 0.601 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O3'-P-O5' 100.211 -1.994 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 19' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.503 0 O4'-C1'-N19 109.38 1.975 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 20' ' ' ' DA' . . . . . 0.664 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-N19 109.233 1.791 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 21' ' ' ' DA' . . . . . 0.664 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 109.497 2.121 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 22' ' ' ' DC' . . . . . 0.516 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.653 2.316 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 23' ' ' ' DC' . . . . . 0.735 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.604 0 O4'-C1'-N19 109.664 2.329 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 24' ' ' ' DT' . . . . . 0.735 ' H71' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.659 0 O3'-P-O5' 100.46 -1.863 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 25' ' ' ' DT' . . . . . 0.614 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 N19-C1'-C2' 116.142 1.214 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 1' ' ' ' DA' . . . . . 0.724 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C5'-C4'-O4' 108.092 -0.817 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 2' ' ' ' DA' . . . . . 0.724 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.893 0 N19-C1'-C2' 116.965 1.728 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 3' ' ' ' DG' . . . . . 0.591 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.788 0 O4'-C1'-N19 109.869 2.586 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 4' ' ' ' DG' . . . . . 0.416 ' C8 ' " H1'" ' F' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.071 2.839 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 5' ' ' ' DT' . . . . . 0.757 H2'' ' H71' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.72 0 O3'-P-O5' 99.352 -2.446 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 6' ' ' ' DT' . . . . . 0.757 ' H71' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O4'-C1'-N19 110.213 3.017 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 7' ' ' ' DT' . . . . . 0.649 ' OP1' ' HB3' ' C' ' 11' ' ' ASP . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O3'-P-O5' 99.331 -2.458 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 8' ' ' ' DC' . . . . . 0.521 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.153 -2.551 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 9' ' ' ' DC' . . . . . 0.585 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O3'-P-O5' 99.506 -2.366 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 10' ' ' ' DA' . . . . . 0.585 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 109.54 2.175 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 11' ' ' ' DA' . . . . . 0.525 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O3'-P-O5' 99.554 -2.34 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 12' ' ' ' DT' . . . . . 0.525 ' H72' " C2'" ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 110.056 2.82 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 13' ' ' ' DA' . . . . . 0.746 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.834 0 O3'-P-O5' 99.4 -2.421 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 14' ' ' ' DA' . . . . . 0.746 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.118 0 O4'-C1'-N19 110.236 3.045 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 15' ' ' ' DT' . . . . . 0.617 H2'' ' C5 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.191 0 O3'-P-O5' 98.987 -2.639 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 16' ' ' ' DT' . . . . . 0.699 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.593 -1.162 0 O3'-P-O5' 99.569 -2.332 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 17' ' ' ' DG' . . . . . 0.699 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O4'-C1'-N19 109.899 2.624 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 18' ' ' ' DT' . . . . . 0.482 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.594 -1.084 0 O3'-P-O5' 98.892 -2.688 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 19' ' ' ' DC' . . . . . 0.846 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.592 -1.28 0 O3'-P-O5' 99.761 -2.231 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 20' ' ' ' DA' . . . . . 0.846 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.866 0 O4'-C1'-N19 109.487 2.108 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 21' ' ' ' DA' . . . . . 0.658 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 O4'-C1'-N19 109.669 2.336 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 22' ' ' ' DT' . . . . . 0.723 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O3'-P-O5' 100.012 -2.099 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 23' ' ' ' DC' . . . . . 0.723 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 N19-C1'-C2' 117.447 2.03 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 24' ' ' ' DA' . . . . . 0.627 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.829 0 O3'-P-O5' 101.224 -1.461 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.712 0 N19-C1'-C2' 116.414 1.384 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 111.901 -0.48 . . . . 3.5699999999999998 111.901 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 4.6799999999999997 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.27 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.4500000000000002 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 2.8900000000000001 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 2.9399999999999999 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.4400000000000004 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.6099999999999999 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.3499999999999996 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.0899999999999999 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 3.6099999999999999 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.3300000000000001 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.53 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.4100000000000001 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.1499999999999999 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HG2' HG21 ' B' ' 36' ' ' ILE . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.71 113.449 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 3.73 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.3099999999999996 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.452 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 3.5800000000000001 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.543 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 2.9500000000000002 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 3.8700000000000001 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.43 HG23 ' HG3' ' D' ' 2' ' ' LYS . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.0899999999999999 111.035 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.4900000000000002 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.7400000000000002 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.1100000000000003 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 4.9900000000000002 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.1699999999999999 111.671 -178.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.1200000000000001 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.527 ' O ' HG22 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 2.9500000000000002 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 2.9500000000000002 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' B' ' 8' ' ' ARG . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.75 110.002 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.1299999999999999 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.1800000000000002 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.6800000000000002 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.2800000000000002 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.1699999999999999 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 2.9100000000000001 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.2599999999999998 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.1000000000000001 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.562 HD22 HD11 ' B' ' 45' ' ' LEU . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.4399999999999999 110.175 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.3899999999999997 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 50' ' ' PRO . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.1399999999999997 108.969 178.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.4199999999999999 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 4.54 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.406 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.0199999999999996 112.329 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 6.6799999999999997 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.4699999999999998 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 5.7699999999999996 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.5499999999999998 110.424 179.735 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 111.463 -0.655 . . . . 4.1100000000000003 111.463 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . 0.676 HG23 ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.25 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.676 ' H ' HG23 ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 3.3199999999999998 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.4699999999999998 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.3999999999999999 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 3.48 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.5199999999999996 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.8899999999999997 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 13' ' ' LEU . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 3.8199999999999998 110.376 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . 0.543 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.7000000000000002 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 3.7799999999999998 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.45 HG11 HD21 ' A' ' 45' ' ' LEU . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.0 108.096 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 2.9100000000000001 112.247 -178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.4399999999999999 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.5699999999999998 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . 0.484 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.2800000000000002 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.7400000000000002 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 3.6499999999999999 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 3.98 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 4.7999999999999998 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.4100000000000001 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 4.8499999999999996 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 3.6899999999999999 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.0099999999999998 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.4299999999999997 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.5599999999999996 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.4699999999999998 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.3999999999999999 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.0 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.542 HG21 ' HG2' ' A' ' 19' ' ' PRO . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.5 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.489 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.3899999999999997 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.6000000000000001 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.7400000000000002 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.3799999999999999 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.407 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 3.7599999999999998 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.3499999999999996 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.4199999999999999 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 2.6899999999999999 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.562 HD11 HD22 ' A' ' 45' ' ' LEU . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.3599999999999999 110.715 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.426 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.21 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.426 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 3.6600000000000001 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.2000000000000002 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.0999999999999996 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 3.8100000000000001 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.2000000000000002 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.1900000000000004 110.329 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . 0.424 ' HB2' ' HB3' ' C' ' 19' ' ' PRO . 1.8 m . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 109.069 -0.715 . . . . 5.0099999999999998 109.069 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . 0.54 HG23 HG12 ' D' ' 38' ' ' VAL . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.25 110.354 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.4700000000000002 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 3.96 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.5299999999999998 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 3.6000000000000001 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 2.6400000000000001 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 2.7000000000000002 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.5699999999999998 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.3900000000000001 111.037 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.1600000000000001 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.55 HH11 HG22 ' D' ' 17' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.0499999999999998 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 2.6400000000000001 111.86 -178.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.4399999999999999 111.362 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.3399999999999999 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . 0.424 ' HB3' ' HB2' ' C' ' 3' ' ' SER . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.6600000000000001 112.579 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.46 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.1799999999999997 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.5299999999999998 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' C' ' 26' ' ' LEU . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.2199999999999998 110.805 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.04 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.0199999999999996 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.0800000000000001 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.4699999999999998 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 3.6899999999999999 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . 0.453 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.5800000000000001 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.1399999999999997 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . 0.468 ' O ' HG23 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.8199999999999998 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . 0.524 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.2599999999999998 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 2.6600000000000001 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.25 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.2400000000000002 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.522 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.3999999999999999 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . 0.535 HG13 ' HB2' ' D' ' 3' ' ' SER . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 2.5499999999999998 112.627 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.1400000000000001 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 2.96 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.3199999999999998 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.27 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.4399999999999999 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.02 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 2.96 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.2000000000000002 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.2400000000000002 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 3.7200000000000002 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . 0.403 ' HB3' ' HB3' ' C' ' 55' ' ' GLN . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.0099999999999998 110.007 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 5.6200000000000001 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.1200000000000001 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . 0.403 ' HB3' ' HB3' ' C' ' 52' ' ' MET . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.3099999999999996 110.492 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 3.6899999999999999 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . 0.43 ' HG3' HG23 ' A' ' 25' ' ' THR . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.5699999999999998 110.509 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.535 ' HB2' HG13 ' C' ' 38' ' ' VAL . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.6400000000000001 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.4399999999999999 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.9199999999999999 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.4500000000000002 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.6099999999999999 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.77 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.1499999999999999 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.571 HG12 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.0800000000000001 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.5899999999999999 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.0599999999999996 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.469 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 4.8399999999999999 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.4300000000000002 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.571 ' H ' HG12 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.5099999999999998 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 2.75 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.55 HG22 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.3599999999999999 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.0800000000000001 109.778 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.46 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . 0.494 ' H ' HD12 ' D' ' 20' ' ' ILE . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 4.8200000000000003 111.523 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.9800000000000004 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.25 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 2.8799999999999999 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.0999999999999996 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 3.73 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 2.9700000000000002 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 2.79 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.1499999999999999 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.46 110.369 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.3999999999999999 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 3.4399999999999999 109.151 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.6600000000000001 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.2999999999999998 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.1099999999999999 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.3399999999999999 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.3300000000000001 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.2400000000000002 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . 0.54 HG12 HG23 ' C' ' 4' ' ' THR . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.1400000000000001 110.777 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.478 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 1.99 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.7599999999999998 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.3500000000000001 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.3399999999999999 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . 0.496 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 1.99 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.0 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 2.77 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.3599999999999999 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 2.9900000000000002 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.483 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.2599999999999998 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.0300000000000002 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.73 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.6200000000000001 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.29 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 5.8300000000000001 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 4.5199999999999996 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.0 110.11 -179.723 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.5699999999999998 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 4.6799999999999997 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.27 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.4500000000000002 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 2.8900000000000001 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 2.9399999999999999 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.717 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.4400000000000004 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.6099999999999999 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.534 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.3499999999999996 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.0899999999999999 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 3.6099999999999999 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.69 HG21 HG23 ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.3300000000000001 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.4100000000000001 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.1499999999999999 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.71 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 3.73 109.848 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.3099999999999996 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 3.5800000000000001 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 2.9500000000000002 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 3.8700000000000001 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.0899999999999999 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.4900000000000002 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.7400000000000002 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.1100000000000003 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 4.9900000000000002 111.279 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.433 ' O ' HG21 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.1699999999999999 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.1200000000000001 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 2.9500000000000002 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 2.9500000000000002 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.513 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.5099999999999998 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.75 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.1299999999999999 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.406 HG12 HG22 ' A' ' 43' ' ' ILE . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.1800000000000002 110.651 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.6800000000000002 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.2800000000000002 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.1699999999999999 110.495 179.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 2.9100000000000001 110.137 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.406 HG22 HG12 ' A' ' 38' ' ' VAL . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.2599999999999998 110.568 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.1000000000000001 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.4399999999999999 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.3899999999999997 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.1399999999999997 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.4199999999999999 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HA ' ' HD2' ' A' ' 50' ' ' PRO . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 4.54 109.798 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HB2' ' A' ' 29' ' ' ALA . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.0199999999999996 112.784 -178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 6.6799999999999997 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.4699999999999998 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 5.7699999999999996 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.5499999999999998 110.939 -179.898 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.1100000000000003 111.211 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.25 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 3.3199999999999998 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.4699999999999998 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.3999999999999999 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.578 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 3.48 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.5199999999999996 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.507 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.8899999999999997 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 3.8199999999999998 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.7000000000000002 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.437 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 3.7799999999999998 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.578 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.0 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 2.9100000000000001 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.69 HG23 HG21 ' A' ' 16' ' ' VAL . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.4399999999999999 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.5699999999999998 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.2800000000000002 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.7400000000000002 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' B' ' 22' ' ' LEU . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 3.6499999999999999 110.483 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 3.98 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 4.7999999999999998 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.4100000000000001 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 4.8499999999999996 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 3.6899999999999999 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.0099999999999998 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.4299999999999997 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.5599999999999996 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.4699999999999998 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 1.98 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.3999999999999999 110.456 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.5 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.405 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.3899999999999997 109.404 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.6000000000000001 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.7400000000000002 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.3799999999999999 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 3.7599999999999998 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.3499999999999996 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.4199999999999999 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 2.6899999999999999 111.014 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.3599999999999999 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.21 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 3.6600000000000001 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.2000000000000002 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.0999999999999996 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 3.8100000000000001 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.2000000000000002 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.1900000000000004 110.254 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.345 0.593 . . . . 5.0099999999999998 110.177 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.25 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.4700000000000002 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 3.96 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.5299999999999998 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 3.6000000000000001 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 2.6400000000000001 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.557 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 2.7000000000000002 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.5699999999999998 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . 0.49 HD22 ' HA ' ' C' ' 13' ' ' LEU . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.3900000000000001 110.064 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.1600000000000001 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.569 ' NE ' HG22 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.0499999999999998 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.411 ' H ' HG13 ' D' ' 16' ' ' VAL . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 2.6400000000000001 110.906 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.4399999999999999 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . 0.408 HG23 ' NE ' ' C' ' 23' ' ' ARG . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.3399999999999999 109.329 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.6600000000000001 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.46 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . 0.404 ' HB2' ' NH1' ' C' ' 24' ' ' ARG . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.1799999999999997 110.648 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.428 HD21 ' HB ' ' D' ' 38' ' ' VAL . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.5299999999999998 110.229 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 23' ' ' ARG . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.2199999999999998 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . 0.404 ' NH1' ' HB2' ' C' ' 21' ' ' GLU . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.04 108.982 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.0199999999999996 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.0800000000000001 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . 0.443 HD13 ' HG2' ' D' ' 41' ' ' GLU . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.4699999999999998 111.829 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 3.6899999999999999 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . 0.44 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.5800000000000001 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.1399999999999997 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.8199999999999998 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.2599999999999998 109.712 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.518 HD23 HG22 ' D' ' 10' ' ' VAL . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 2.6600000000000001 111.192 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.46 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.25 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' D' ' 8' ' ' ARG . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.2400000000000002 110.779 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.3999999999999999 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 2.5499999999999998 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . 0.441 ' CB ' HD13 ' C' ' 44' ' ' ILE . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.1400000000000001 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 2.96 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.3199999999999998 109.863 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' C' ' 39' ' ' ASP . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.27 110.794 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.503 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.4399999999999999 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.02 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 2.96 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.2400000000000002 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 3.7200000000000002 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.0099999999999998 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 5.6200000000000001 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.1200000000000001 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.3099999999999996 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 3.6899999999999999 110.503 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.5699999999999998 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.6400000000000001 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.4399999999999999 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.9199999999999999 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.4500000000000002 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.6099999999999999 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.58 ' HB2' HD11 ' C' ' 36' ' ' ILE . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.77 109.101 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.1499999999999999 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.518 HG22 HD23 ' C' ' 34' ' ' LEU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.0800000000000001 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.5899999999999999 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.0599999999999996 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 4.8399999999999999 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.4300000000000002 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.5099999999999998 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 2.75 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.569 HG22 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.3599999999999999 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.0800000000000001 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.46 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 4.8200000000000003 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' D' ' 24' ' ' ARG . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.9800000000000004 109.904 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.25 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 2.8799999999999999 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' D' ' 21' ' ' GLU . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.0999999999999996 110.019 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 3.73 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 2.9700000000000002 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 2.79 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.1499999999999999 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.46 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.663 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.3999999999999999 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 3.4399999999999999 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.6600000000000001 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.2999999999999998 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.1099999999999999 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.3399999999999999 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.3300000000000001 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.2400000000000002 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . 0.428 ' HB ' HD21 ' C' ' 22' ' ' LEU . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.1400000000000001 111.042 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 1.99 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.7599999999999998 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . 0.443 ' HG2' HD13 ' C' ' 28' ' ' ILE . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.3500000000000001 110.919 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.3399999999999999 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 1.99 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . 0.471 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.0 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 2.77 110.181 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.3599999999999999 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 2.9900000000000002 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.452 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.2599999999999998 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.0300000000000002 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.73 111.946 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.6200000000000001 110.187 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.29 110.25 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 5.8300000000000001 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 4.5199999999999996 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.0 110.152 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.783 0 N-CA-C 112.291 -0.324 . . . . 3.5699999999999998 112.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 4.6799999999999997 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.27 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.4500000000000002 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 2.8900000000000001 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 2.9399999999999999 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.4400000000000004 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.6099999999999999 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.414 ' H ' ' C ' ' A' ' 11' ' ' ASP . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.3499999999999996 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.0899999999999999 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 3.6099999999999999 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.3300000000000001 110.776 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.4100000000000001 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.1499999999999999 111.077 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.71 112.608 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 3.73 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.3099999999999996 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 3.5800000000000001 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 2.9500000000000002 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 3.8700000000000001 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.0899999999999999 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.4900000000000002 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.7400000000000002 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.1100000000000003 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 4.9900000000000002 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.1699999999999999 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.572 ' HA ' HG11 ' B' ' 10' ' ' VAL . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.1200000000000001 111.341 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 2.9500000000000002 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 2.9500000000000002 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 7' ' ' VAL . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.5099999999999998 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.75 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.535 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.1299999999999999 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.1800000000000002 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.535 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.6800000000000002 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.2800000000000002 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.1699999999999999 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 2.9100000000000001 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.2599999999999998 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.1000000000000001 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.4399999999999999 110.264 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.3899999999999997 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.1399999999999997 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.4199999999999999 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 4.54 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.0199999999999996 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 6.6799999999999997 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.4699999999999998 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 5.7699999999999996 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.5499999999999998 110.168 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 111.99 -0.444 . . . . 4.1100000000000003 111.99 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.25 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.611 HG22 ' HG2' ' A' ' 35' ' ' GLU . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 3.3199999999999998 110.153 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.4699999999999998 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.3999999999999999 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 31' ' ' LYS . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 3.48 112.093 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.5199999999999996 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.8899999999999997 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.464 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 3.8199999999999998 110.251 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.7000000000000002 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 3.7799999999999998 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.0 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.528 HG12 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 2.9100000000000001 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.528 ' H ' HG12 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.4399999999999999 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . 0.457 ' HD2' HG13 ' B' ' 18' ' ' ILE . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.5699999999999998 113.97 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.2800000000000002 111.535 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.7400000000000002 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' B' ' 26' ' ' LEU . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 3.6499999999999999 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 3.98 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 4.7999999999999998 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.4100000000000001 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 4.8499999999999996 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 3.6899999999999999 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.0099999999999998 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.4299999999999997 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.5599999999999996 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.4699999999999998 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 1.98 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.415 HD13 HD23 ' B' ' 45' ' ' LEU . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.3999999999999999 110.335 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.0 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.5 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.3899999999999997 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.6000000000000001 109.678 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.7400000000000002 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.3799999999999999 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 3.7599999999999998 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.3499999999999996 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.4199999999999999 111.688 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 2.6899999999999999 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.415 HD23 HD13 ' B' ' 34' ' ' LEU . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.3599999999999999 110.962 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.21 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 3.6600000000000001 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.2000000000000002 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.478 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.0999999999999996 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 3.8100000000000001 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.2000000000000002 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.1900000000000004 111.219 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.682 0.277 . . . . 5.0099999999999998 111.563 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.25 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.4700000000000002 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . 0.426 ' H ' HG13 ' C' ' 6' ' ' ILE . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 3.96 110.11 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.5299999999999998 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 3.6000000000000001 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 2.6400000000000001 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.419 HG22 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 2.7000000000000002 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.5699999999999998 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.3900000000000001 109.973 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . 0.438 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.1600000000000001 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.66 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.0499999999999998 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.482 HG21 HD12 ' D' ' 34' ' ' LEU . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 2.6400000000000001 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.4399999999999999 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . 0.44 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.3399999999999999 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.6600000000000001 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.46 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.1799999999999997 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.5299999999999998 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.461 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.2199999999999998 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.04 109.638 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.0199999999999996 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.0800000000000001 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . 0.474 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.4699999999999998 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 3.6899999999999999 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.5800000000000001 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . 0.575 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.1399999999999997 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.8199999999999998 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.2599999999999998 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 2.6600000000000001 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.25 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.2400000000000002 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' D' ' 3' ' ' SER . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.3999999999999999 109.017 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 2.5499999999999998 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.1400000000000001 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 2.96 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.3199999999999998 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.27 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.436 HD23 HD13 ' C' ' 34' ' ' LEU . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.4399999999999999 109.861 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.02 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' C' ' 47' ' ' LYS . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 2.96 109.352 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.2000000000000002 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.2400000000000002 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 3.7200000000000002 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.0099999999999998 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 5.6200000000000001 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.1200000000000001 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.3099999999999996 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 3.6899999999999999 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' D' ' 6' ' ' ILE . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.5699999999999998 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.6400000000000001 111.957 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.4399999999999999 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.9199999999999999 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . 0.423 HD12 ' HB2' ' D' ' 2' ' ' LYS . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.4500000000000002 110.102 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.6099999999999999 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.77 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.1499999999999999 112.009 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.0800000000000001 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.575 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.5899999999999999 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.0599999999999996 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 4.8399999999999999 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.4300000000000002 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.534 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.5099999999999998 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 2.75 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.3599999999999999 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.0800000000000001 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.46 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 4.8200000000000003 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.9800000000000004 111.225 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.25 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . 0.438 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 2.8799999999999999 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.0999999999999996 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 3.73 110.466 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 2.9700000000000002 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 2.79 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . 0.401 HG22 ' HE1' ' D' ' 48' ' ' TYR . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.1499999999999999 110.436 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.46 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.569 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.3999999999999999 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 3.4399999999999999 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.6600000000000001 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.523 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.1099999999999999 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.3399999999999999 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.3300000000000001 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . 0.452 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.2400000000000002 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.1400000000000001 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 1.99 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.7599999999999998 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.3500000000000001 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.3399999999999999 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 1.99 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . 0.452 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.0 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 2.77 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.3599999999999999 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 2.9900000000000002 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.418 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.2599999999999998 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.0300000000000002 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.73 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.6200000000000001 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . 0.439 ' HG3' ' H ' ' D' ' 54' ' ' CYS . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.29 110.462 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 5.8300000000000001 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . 0.439 ' H ' ' HG3' ' D' ' 52' ' ' MET . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 4.5199999999999996 111.373 -179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.0 111.873 178.394 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.542 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.614 -0.595 . . . . 3.5699999999999998 111.614 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 4.6799999999999997 109.696 -178.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.446 ' CG1' ' HB1' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.27 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.4500000000000002 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 2.8900000000000001 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.558 HG21 HD12 ' B' ' 34' ' ' LEU . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 2.9399999999999999 110.452 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.4400000000000004 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.6099999999999999 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.3499999999999996 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.0899999999999999 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 3.6099999999999999 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.3300000000000001 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.433 ' HA ' ' HA ' ' B' ' 15' ' ' ARG . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.4100000000000001 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.1499999999999999 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.447 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.71 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 3.73 111.212 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.3099999999999996 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 3.5800000000000001 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 2.9500000000000002 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 3.8700000000000001 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.0899999999999999 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 ' HD3' ' A' ' 47' ' ' LYS . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.4900000000000002 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.7400000000000002 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.1100000000000003 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 4.9900000000000002 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.1699999999999999 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.1200000000000001 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' HG23 ' B' ' 10' ' ' VAL . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 2.9500000000000002 110.352 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 2.9500000000000002 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HG2' HG12 ' B' ' 7' ' ' VAL . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.5099999999999998 110.634 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.493 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.75 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.525 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.1299999999999999 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.1800000000000002 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.6800000000000002 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.2800000000000002 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.1699999999999999 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 2.9100000000000001 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.2599999999999998 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.1000000000000001 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.512 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.4399999999999999 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.3899999999999997 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.603 ' HD3' HD11 ' A' ' 26' ' ' LEU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.1399999999999997 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.4199999999999999 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 4.54 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.0199999999999996 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 6.6799999999999997 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.4699999999999998 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 5.7699999999999996 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.5499999999999998 111.368 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . 0.525 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.41 -0.106 . . . . 4.1100000000000003 112.837 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.25 111.096 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' GLU . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 3.3199999999999998 110.233 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.4699999999999998 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.432 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.3999999999999999 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.463 HG23 ' HA ' ' A' ' 33' ' ' ALA . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 3.48 110.062 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.5199999999999996 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.8899999999999997 110.166 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 3.8199999999999998 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.7000000000000002 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 3.7799999999999998 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.0 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 2.9100000000000001 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.4399999999999999 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.5699999999999998 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.2800000000000002 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' B' ' 21' ' ' GLU . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.7400000000000002 109.685 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 3.6499999999999999 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 3.98 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 4.7999999999999998 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.4100000000000001 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 4.8499999999999996 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 3.6899999999999999 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.0099999999999998 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.4299999999999997 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.5599999999999996 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.4699999999999998 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.446 ' HB1' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 1.98 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.558 HD12 HG21 ' A' ' 10' ' ' VAL . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.3999999999999999 109.487 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.0 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.5 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.564 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.3899999999999997 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.542 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.6000000000000001 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.7400000000000002 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.3799999999999999 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.446 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 3.7599999999999998 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.3499999999999996 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.4199999999999999 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.564 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 2.6899999999999999 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.3599999999999999 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.21 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 3.6600000000000001 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.2000000000000002 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 3.8100000000000001 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.2000000000000002 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.1900000000000004 110.621 179.749 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . 0.41 ' OG ' HD11 ' C' ' 22' ' ' LEU . 19.3 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.318 0.58 . . . . 5.0099999999999998 110.883 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.25 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.4700000000000002 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 3.96 110.748 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.414 HG22 ' H ' ' C' ' 7' ' ' VAL . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.5299999999999998 110.486 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 3.6000000000000001 110.468 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 2.6400000000000001 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 2.7000000000000002 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.5699999999999998 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.3900000000000001 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.1600000000000001 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' OD2' ' D' ' 11' ' ' ASP . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.0499999999999998 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.483 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 2.6400000000000001 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . 0.407 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.4399999999999999 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.3399999999999999 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.6600000000000001 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.46 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.1799999999999997 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.41 HD11 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.5299999999999998 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.455 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.2199999999999998 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.04 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.0199999999999996 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.0800000000000001 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.4699999999999998 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 3.6899999999999999 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . 0.428 ' HB2' ' HE3' ' C' ' 31' ' ' LYS . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.5800000000000001 110.267 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' C' ' 30' ' ' GLU . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.1399999999999997 109.875 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.8199999999999998 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.2599999999999998 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 2.6600000000000001 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.25 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.2400000000000002 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.3999999999999999 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 2.5499999999999998 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.1400000000000001 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 2.96 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.3199999999999998 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . 0.584 HG22 HD13 ' D' ' 44' ' ' ILE . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.27 110.845 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.4399999999999999 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.02 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 2.96 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.2000000000000002 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.2400000000000002 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 3.7200000000000002 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.0099999999999998 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 5.6200000000000001 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.1200000000000001 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.3099999999999996 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . 0.417 ' N ' ' HB2' ' A' ' 21' ' ' GLU . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 3.6899999999999999 110.236 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.5699999999999998 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.6400000000000001 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.4399999999999999 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . 0.491 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.9199999999999999 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.4500000000000002 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.6099999999999999 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.684 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.77 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.1499999999999999 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.0800000000000001 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.493 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.5899999999999999 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.0599999999999996 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 4.8399999999999999 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.4300000000000002 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.489 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.5099999999999998 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.483 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 2.75 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.684 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.3599999999999999 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.0800000000000001 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.46 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 4.8200000000000003 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.9800000000000004 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . 0.427 ' HA ' HD23 ' D' ' 22' ' ' LEU . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.25 110.228 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 2.8799999999999999 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.0999999999999996 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 3.73 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 2.9700000000000002 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 2.79 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.1499999999999999 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.46 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.475 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.3999999999999999 111.121 -179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 3.4399999999999999 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.6600000000000001 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . 0.58 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.2999999999999998 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.414 ' CD2' ' HA ' ' D' ' 47' ' ' LYS . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.1099999999999999 109.739 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.3399999999999999 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . 0.407 HG12 HD12 ' D' ' 45' ' ' LEU . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.3300000000000001 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.2400000000000002 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.1400000000000001 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 1.99 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.7599999999999998 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.3500000000000001 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.3399999999999999 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 1.99 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . 0.584 HD13 HG22 ' C' ' 44' ' ' ILE . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.0 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . 0.407 HD12 HG12 ' D' ' 36' ' ' ILE . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 2.77 110.836 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.459 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.3599999999999999 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . 0.414 ' HA ' ' CD2' ' D' ' 34' ' ' LEU . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 2.9900000000000002 110.498 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.2599999999999998 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.0300000000000002 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.73 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.6200000000000001 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.29 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 5.8300000000000001 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 4.5199999999999996 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.0 110.512 179.942 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 112.473 -0.251 . . . . 3.5699999999999998 112.473 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 4.6799999999999997 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG21 ' SD ' ' B' ' 52' ' ' MET . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.27 109.905 179.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.4500000000000002 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 2.8900000000000001 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 2.9399999999999999 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.4400000000000004 110.527 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.6099999999999999 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.3499999999999996 110.785 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.0899999999999999 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 3.6099999999999999 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.3300000000000001 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.4100000000000001 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.71 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 3.73 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.3099999999999996 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 3.5800000000000001 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 2.9500000000000002 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 3.8700000000000001 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.0899999999999999 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.4900000000000002 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.7400000000000002 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.1100000000000003 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 4.9900000000000002 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' O ' HG21 ' B' ' 10' ' ' VAL . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.1699999999999999 111.32 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.52 ' HA ' HG11 ' B' ' 10' ' ' VAL . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.1200000000000001 110.965 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 2.9500000000000002 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 2.9500000000000002 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HG2' HG22 ' B' ' 7' ' ' VAL . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.5099999999999998 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.75 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.1299999999999999 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.1800000000000002 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.6800000000000002 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.2800000000000002 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.1699999999999999 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 2.9100000000000001 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.2599999999999998 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.1000000000000001 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.417 HD21 HG11 ' B' ' 16' ' ' VAL . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.4399999999999999 111.058 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.3899999999999997 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.1399999999999997 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.4199999999999999 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 4.54 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.0199999999999996 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 6.6799999999999997 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.4699999999999998 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 5.7699999999999996 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.5499999999999998 110.102 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.25 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.646 HG22 ' HG2' ' A' ' 35' ' ' GLU . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 3.3199999999999998 109.699 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' B' ' 8' ' ' ARG . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.4699999999999998 110.952 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' B' ' 10' ' ' VAL . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.3999999999999999 110.673 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 31' ' ' LYS . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 3.48 111.361 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.5199999999999996 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.8899999999999997 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.476 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 3.8199999999999998 109.92 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.7000000000000002 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.471 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 3.7799999999999998 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.0 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.464 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 2.9100000000000001 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.4399999999999999 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.5699999999999998 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.2800000000000002 111.722 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.7400000000000002 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 3.6499999999999999 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 3.98 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 4.7999999999999998 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.4100000000000001 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.439 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 4.8499999999999996 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . 0.439 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 3.6899999999999999 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . 0.486 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.0099999999999998 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.4299999999999997 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.5599999999999996 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.4699999999999998 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.486 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 1.98 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.3999999999999999 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.0 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.522 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.5 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.3899999999999997 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.6000000000000001 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.7400000000000002 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.3799999999999999 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 3.7599999999999998 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.3499999999999996 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.4199999999999999 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 2.6899999999999999 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.3599999999999999 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.21 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 3.6600000000000001 111.156 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.2000000000000002 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.0999999999999996 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 3.8100000000000001 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.2000000000000002 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . 0.408 ' SD ' HG21 ' A' ' 7' ' ' VAL . 85.5 mmm . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.1900000000000004 110.384 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.617 0.246 . . . . 5.0099999999999998 111.606 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . 0.446 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.25 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 3.96 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.5299999999999998 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 3.6000000000000001 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 2.6400000000000001 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.502 HG13 HG22 ' C' ' 16' ' ' VAL . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 2.7000000000000002 108.696 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.5699999999999998 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.3900000000000001 109.909 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.1600000000000001 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.419 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.0499999999999998 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.502 HG22 HG13 ' C' ' 10' ' ' VAL . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 2.6400000000000001 109.858 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.4399999999999999 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . 0.414 HG13 ' HD2' ' C' ' 19' ' ' PRO . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.3399999999999999 109.792 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' C' ' 18' ' ' ILE . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.6600000000000001 110.919 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.46 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.1799999999999997 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.5299999999999998 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.463 ' HD2' HD11 ' C' ' 28' ' ' ILE . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.2199999999999998 109.851 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.04 110.583 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.0199999999999996 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.0800000000000001 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . 0.463 HD11 ' HD2' ' C' ' 23' ' ' ARG . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.4699999999999998 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 3.6899999999999999 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.5800000000000001 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.1399999999999997 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . 0.512 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.8199999999999998 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.2599999999999998 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 2.6600000000000001 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.25 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.2400000000000002 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.3999999999999999 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . 0.475 HG13 ' CB ' ' D' ' 3' ' ' SER . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 2.5499999999999998 111.767 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.1400000000000001 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 2.96 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.3199999999999998 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.27 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.4399999999999999 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.02 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 2.96 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.2000000000000002 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.2400000000000002 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 3.7200000000000002 109.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.0099999999999998 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 5.6200000000000001 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.1200000000000001 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.3099999999999996 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 3.6899999999999999 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.5699999999999998 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.6400000000000001 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.4399999999999999 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.9199999999999999 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.4500000000000002 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.6099999999999999 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.567 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.77 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.1499999999999999 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.536 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.0800000000000001 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.5899999999999999 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.419 ' CD ' HH12 ' C' ' 15' ' ' ARG . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.0599999999999996 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 4.8399999999999999 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . 0.536 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.4300000000000002 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.5099999999999998 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 2.75 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.3599999999999999 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.0800000000000001 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.46 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . 0.451 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 4.8200000000000003 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.9800000000000004 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.25 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 2.8799999999999999 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.0999999999999996 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 3.73 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 2.9700000000000002 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 2.79 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . 0.432 HG22 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.1499999999999999 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.46 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.3999999999999999 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 3.4399999999999999 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.6600000000000001 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.2999999999999998 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.481 HD12 HG11 ' C' ' 16' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.1099999999999999 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.3399999999999999 108.302 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.3300000000000001 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.2400000000000002 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.1400000000000001 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 1.99 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.7599999999999998 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.3500000000000001 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.3399999999999999 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 1.99 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.0 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 2.77 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.3599999999999999 111.167 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 2.9900000000000002 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.432 ' CE1' HG22 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.2599999999999998 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.0300000000000002 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.73 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.6200000000000001 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.29 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 5.8300000000000001 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 4.5199999999999996 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.0 111.145 179.78 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 111.396 -0.681 . . . . 3.5699999999999998 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 4.6799999999999997 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.27 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.4500000000000002 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 2.9399999999999999 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.4400000000000004 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.693 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.6099999999999999 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.55 HD22 HH12 ' A' ' 15' ' ' ARG . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.3499999999999996 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.0899999999999999 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.55 HH12 HD22 ' A' ' 13' ' ' LEU . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 3.6099999999999999 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.3300000000000001 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.4100000000000001 110.182 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.1499999999999999 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.513 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.71 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.42 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 3.73 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.3099999999999996 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 3.5800000000000001 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 2.9500000000000002 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 3.8700000000000001 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.0899999999999999 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.4900000000000002 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.7400000000000002 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.1100000000000003 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 4.9900000000000002 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.1699999999999999 110.932 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.1200000000000001 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 2.9500000000000002 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' HG22 ' B' ' 10' ' ' VAL . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 2.9500000000000002 111.251 -179.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.5099999999999998 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.466 ' HB ' HG23 ' B' ' 6' ' ' ILE . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.75 110.322 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.1299999999999999 111.155 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.1800000000000002 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.6800000000000002 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.2800000000000002 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.1699999999999999 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 2.9100000000000001 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.2599999999999998 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.1000000000000001 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.407 HD11 ' HB3' ' A' ' 34' ' ' LEU . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.4399999999999999 109.253 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.3899999999999997 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.1399999999999997 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.4199999999999999 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 4.54 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.0199999999999996 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 6.6799999999999997 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.4699999999999998 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 5.7699999999999996 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.5499999999999998 109.997 179.224 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.795 0 N-CA-C 112.122 -0.391 . . . . 4.1100000000000003 112.122 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . 0.466 HG23 ' HB ' ' A' ' 36' ' ' ILE . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.25 110.204 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.552 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 3.3199999999999998 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.4699999999999998 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.3999999999999999 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.421 HG22 ' HG ' ' A' ' 34' ' ' LEU . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 3.48 110.093 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.5199999999999996 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.8899999999999997 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 3.8199999999999998 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . 0.475 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.7000000000000002 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.475 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 3.7799999999999998 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.0 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.451 HG12 ' HB3' ' A' ' 15' ' ' ARG . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 2.9100000000000001 111.618 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 43' ' ' ILE . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.4399999999999999 110.048 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.5699999999999998 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . 0.439 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.2800000000000002 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.7400000000000002 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 3.6499999999999999 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.493 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 3.98 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.439 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 4.7999999999999998 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.4100000000000001 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 4.8499999999999996 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 3.6899999999999999 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.0099999999999998 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.4299999999999997 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.5599999999999996 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.4699999999999998 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.3999999999999999 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.0 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.423 HG22 ' HG ' ' B' ' 45' ' ' LEU . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.5 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.3899999999999997 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.6000000000000001 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.428 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.7400000000000002 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.3799999999999999 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 3.7599999999999998 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.3499999999999996 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.4199999999999999 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 2.6899999999999999 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.507 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.3599999999999999 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.21 110.866 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 3.6600000000000001 110.356 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.2000000000000002 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.0999999999999996 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 3.8100000000000001 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.2000000000000002 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.1900000000000004 110.881 -179.179 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 120.661 0.267 . . . . 5.0099999999999998 110.921 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.25 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.4700000000000002 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 3.96 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.5299999999999998 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 3.6000000000000001 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 2.6400000000000001 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 2.7000000000000002 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.5699999999999998 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . 0.582 HD21 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.3900000000000001 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.1600000000000001 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.0499999999999998 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 2.6400000000000001 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.4399999999999999 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.3399999999999999 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.6600000000000001 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.46 111.03 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.1799999999999997 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' C' ' 22' ' ' LEU . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.5299999999999998 111.433 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.524 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.2199999999999998 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.04 111.418 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.0199999999999996 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.0800000000000001 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.4699999999999998 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 3.6899999999999999 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.5800000000000001 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.1399999999999997 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.8199999999999998 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.2599999999999998 110.554 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 2.6600000000000001 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.25 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.2400000000000002 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.3999999999999999 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 2.5499999999999998 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.1400000000000001 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 2.96 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . 0.468 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.3199999999999998 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.27 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.4399999999999999 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.02 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 2.96 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.2000000000000002 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.2400000000000002 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 3.7200000000000002 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.0099999999999998 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 5.6200000000000001 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.1200000000000001 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.3099999999999996 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 3.6899999999999999 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.5699999999999998 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.41 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.6400000000000001 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.4399999999999999 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.9199999999999999 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.4500000000000002 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' HB1' ' C' ' 33' ' ' ALA . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.6099999999999999 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.77 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.1499999999999999 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.544 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.5899999999999999 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.0599999999999996 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.544 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 4.8399999999999999 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . 0.524 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.4300000000000002 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.582 HH11 HD21 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.5099999999999998 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.617 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 2.75 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.492 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.3599999999999999 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.0800000000000001 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.46 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 4.8200000000000003 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.9800000000000004 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . 0.41 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.25 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 2.8799999999999999 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.0999999999999996 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 3.73 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 2.9700000000000002 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 2.79 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.1499999999999999 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.46 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.3999999999999999 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 3.4399999999999999 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.6600000000000001 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.2999999999999998 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.478 ' HB3' HD11 ' D' ' 45' ' ' LEU . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1099999999999999 110.261 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.3399999999999999 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.3300000000000001 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.2400000000000002 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.1400000000000001 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.63 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.7599999999999998 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.3500000000000001 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.3399999999999999 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 1.99 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.0 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' D' ' 34' ' ' LEU . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 2.77 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.3599999999999999 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 2.9900000000000002 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.2599999999999998 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.0300000000000002 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.73 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.6200000000000001 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.29 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 5.8300000000000001 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 4.5199999999999996 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.0 110.041 -179.055 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.389 0 N-CA-C 112.362 -0.295 . . . . 3.5699999999999998 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 4.6799999999999997 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.27 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.4500000000000002 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 2.8900000000000001 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.409 HG22 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 2.9399999999999999 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.4400000000000004 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.6099999999999999 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.3499999999999996 111.499 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.0899999999999999 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.503 ' HG3' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 3.6099999999999999 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.603 HG13 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.3300000000000001 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.4100000000000001 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.1499999999999999 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.71 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 3.73 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.3099999999999996 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 3.5800000000000001 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 2.9500000000000002 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 3.8700000000000001 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.0899999999999999 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.4900000000000002 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.7400000000000002 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.1100000000000003 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 4.9900000000000002 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.1699999999999999 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' B' ' 10' ' ' VAL . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.1200000000000001 110.208 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 2.9500000000000002 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 2.9500000000000002 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.5099999999999998 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.75 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.1299999999999999 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.1800000000000002 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.6800000000000002 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.2800000000000002 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.512 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.1699999999999999 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.512 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 2.9100000000000001 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.437 ' HB ' ' HB3' ' B' ' 45' ' ' LEU . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.2599999999999998 108.807 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.433 HG22 ' HG3' ' A' ' 46' ' ' LYS . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.1000000000000001 111.33 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.4399999999999999 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 44' ' ' ILE . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.3899999999999997 109.872 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.1399999999999997 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.58 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.4199999999999999 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 4.54 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.0199999999999996 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 6.6799999999999997 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.4699999999999998 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.555 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 5.7699999999999996 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.5499999999999998 109.845 179.607 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.502 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.25 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 3.3199999999999998 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.4699999999999998 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.3999999999999999 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.424 HG21 ' HA ' ' A' ' 31' ' ' LYS . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 3.48 109.542 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.5199999999999996 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.8899999999999997 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 3.8199999999999998 109.802 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.7000000000000002 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 3.7799999999999998 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.0 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 15' ' ' ARG . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 2.9100000000000001 111.531 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.44 HG23 ' HD2' ' B' ' 19' ' ' PRO . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.4399999999999999 109.172 178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG23 ' B' ' 18' ' ' ILE . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.5699999999999998 113.109 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.2800000000000002 112.625 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.7400000000000002 111.872 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 3.6499999999999999 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.403 ' HA ' ' HA2' ' B' ' 27' ' ' GLY . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 3.98 111.146 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 4.7999999999999998 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.4100000000000001 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 4.8499999999999996 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' B' ' 23' ' ' ARG . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 3.6899999999999999 111.268 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . 0.414 HD11 HG21 ' B' ' 18' ' ' ILE . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.0099999999999998 111.406 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.4299999999999997 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.5599999999999996 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.4699999999999998 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.409 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 1.98 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.3999999999999999 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.0 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.5 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.3899999999999997 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.6000000000000001 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.7400000000000002 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.3799999999999999 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 3.7599999999999998 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.3499999999999996 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.4199999999999999 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 2.6899999999999999 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' ILE . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.3599999999999999 109.787 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.21 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 3.6600000000000001 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.2000000000000002 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.0999999999999996 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 3.8100000000000001 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' B' ' 52' ' ' MET . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.2000000000000002 111.422 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . 0.443 ' H ' ' HB3' ' B' ' 51' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.1900000000000004 110.289 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . 0.512 ' HA ' HD11 ' C' ' 6' ' ' ILE . 4.2 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.414 0.626 . . . . 5.0099999999999998 110.038 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.25 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.4700000000000002 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' C' ' 3' ' ' SER . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 3.96 110.054 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.5299999999999998 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 3.6000000000000001 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 2.6400000000000001 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 2.7000000000000002 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.5699999999999998 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' C' ' 13' ' ' LEU . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.3900000000000001 110.95 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.1600000000000001 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.0499999999999998 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 2.6400000000000001 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . 0.776 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.4399999999999999 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . 0.46 ' H ' HD12 ' C' ' 18' ' ' ILE . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.3399999999999999 109.602 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.6600000000000001 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . 0.444 ' H ' HD12 ' C' ' 20' ' ' ILE . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.46 111.421 -179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.1799999999999997 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.62 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.5299999999999998 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' C' ' 23' ' ' ARG . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.2199999999999998 110.818 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.04 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.0199999999999996 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.0800000000000001 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.4699999999999998 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 3.6899999999999999 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.5800000000000001 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . 0.496 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.1399999999999997 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.8199999999999998 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . 0.543 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.2599999999999998 110.899 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 2.6600000000000001 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.689 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.25 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.2400000000000002 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.3999999999999999 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 2.5499999999999998 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.1400000000000001 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 2.96 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.3199999999999998 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.27 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.02 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 2.96 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.2000000000000002 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.2400000000000002 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 3.7200000000000002 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.0099999999999998 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 5.6200000000000001 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . 0.555 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.1200000000000001 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.3099999999999996 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . 0.451 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 3.6899999999999999 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.5699999999999998 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.6400000000000001 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.4399999999999999 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.9199999999999999 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.4500000000000002 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.569 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.6099999999999999 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.451 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.77 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . 0.414 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.1499999999999999 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' C' ' 33' ' ' ALA . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.0800000000000001 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.602 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.5899999999999999 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.496 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.0599999999999996 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' D' ' 13' ' ' LEU . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 4.8399999999999999 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.4300000000000002 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.776 ' HA ' HG22 ' C' ' 17' ' ' VAL . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.5099999999999998 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 2.75 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.3599999999999999 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.0800000000000001 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.46 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 4.8200000000000003 110.522 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.9800000000000004 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.25 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 2.8799999999999999 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.0999999999999996 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 3.73 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 2.9700000000000002 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 2.79 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.1499999999999999 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.46 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.3999999999999999 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 3.4399999999999999 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.6600000000000001 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.2999999999999998 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.1099999999999999 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.3399999999999999 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.3300000000000001 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.2400000000000002 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.1400000000000001 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 1.99 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.7599999999999998 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.3500000000000001 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.3399999999999999 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 1.99 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.0 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 2.77 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.435 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.3599999999999999 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 2.9900000000000002 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.2599999999999998 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.0300000000000002 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.73 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.6200000000000001 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.29 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 5.8300000000000001 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 4.5199999999999996 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.0 109.564 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.5699999999999998 110.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 4.6799999999999997 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.27 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.4500000000000002 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 2.8900000000000001 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 2.9399999999999999 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.467 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.4400000000000004 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.6099999999999999 109.993 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.3499999999999996 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.0899999999999999 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 3.6099999999999999 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.721 HG22 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.3300000000000001 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.4100000000000001 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.1499999999999999 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.608 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.71 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 3.73 111.277 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.3099999999999996 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 3.5800000000000001 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 2.9500000000000002 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 3.8700000000000001 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.0899999999999999 111.141 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.4900000000000002 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.7400000000000002 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.1100000000000003 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 4.9900000000000002 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.1699999999999999 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.1200000000000001 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 2.9500000000000002 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 45' ' ' LEU . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 2.9500000000000002 110.671 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.5099999999999998 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.75 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.1299999999999999 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.1800000000000002 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.6800000000000002 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.2800000000000002 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.1699999999999999 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 2.9100000000000001 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.2599999999999998 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.1000000000000001 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.4399999999999999 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.3899999999999997 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.1399999999999997 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.4199999999999999 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 4.54 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.574 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.0199999999999996 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 6.6799999999999997 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.4699999999999998 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 5.7699999999999996 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t . . . . . 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.5499999999999998 111.216 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 111.345 -0.702 . . . . 4.1100000000000003 111.345 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . 0.476 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.25 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 3.3199999999999998 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.4699999999999998 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.3999999999999999 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 3.48 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.5199999999999996 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.8899999999999997 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 3.8199999999999998 110.363 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.7000000000000002 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 3.7799999999999998 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.0 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 2.9100000000000001 111.201 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.4399999999999999 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.5699999999999998 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.2800000000000002 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.7400000000000002 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 3.6499999999999999 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 3.98 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 4.7999999999999998 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.4100000000000001 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 4.8499999999999996 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 3.6899999999999999 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.0099999999999998 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.4299999999999997 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.5599999999999996 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.4699999999999998 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 1.98 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.3999999999999999 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.0 110.332 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.5 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.3899999999999997 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.601 HG22 HG23 ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.6000000000000001 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.7400000000000002 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.3799999999999999 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 3.7599999999999998 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.3499999999999996 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.601 HG23 HG22 ' B' ' 38' ' ' VAL . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.4199999999999999 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.659 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.3599999999999999 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.21 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 3.6600000000000001 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.2000000000000002 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.0999999999999996 110.438 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 3.8100000000000001 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.2000000000000002 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.1900000000000004 110.443 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 120.764 0.316 . . . . 5.0099999999999998 110.15 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.25 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.4700000000000002 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 3.96 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.5299999999999998 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 3.6000000000000001 110.104 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 2.6400000000000001 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 2.7000000000000002 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . 0.4 ' HB3' ' N ' ' C' ' 15' ' ' ARG . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.5699999999999998 109.178 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.3900000000000001 111.652 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.1600000000000001 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.0499999999999998 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 2.6400000000000001 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . 0.463 HG22 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.4399999999999999 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.3399999999999999 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . 0.548 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.6600000000000001 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . 0.441 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.46 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.1799999999999997 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.5299999999999998 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.2199999999999998 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . 0.441 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.04 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . 0.413 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.0199999999999996 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.0800000000000001 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.4699999999999998 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 3.6899999999999999 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.5800000000000001 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . 0.483 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.1399999999999997 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.8199999999999998 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.2599999999999998 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 2.6600000000000001 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.507 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.25 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.2400000000000002 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.3999999999999999 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' C' ' 43' ' ' ILE . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 2.5499999999999998 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.1400000000000001 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 2.96 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . 0.556 ' HA ' HG12 ' C' ' 38' ' ' VAL . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.3199999999999998 109.801 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.27 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . 0.423 ' HB3' HD23 ' C' ' 34' ' ' LEU . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.4399999999999999 109.768 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.02 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 2.96 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.2000000000000002 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.2400000000000002 109.588 -179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 3.7200000000000002 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.0099999999999998 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . 0.412 ' O ' ' HB3' ' C' ' 54' ' ' CYS . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 5.6200000000000001 110.034 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' C' ' 53' ' ' THR . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.1200000000000001 111.437 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.3099999999999996 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 3.6899999999999999 110.253 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.5699999999999998 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.494 ' O ' HG22 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.6400000000000001 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.4399999999999999 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.9199999999999999 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.4500000000000002 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.6099999999999999 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.77 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.1499999999999999 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.0800000000000001 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.5899999999999999 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.0599999999999996 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.512 ' HA ' HD13 ' D' ' 13' ' ' LEU . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 4.8399999999999999 111.386 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.4300000000000002 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.463 ' HE ' HG22 ' C' ' 17' ' ' VAL . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.5099999999999998 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 2.75 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.543 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.3599999999999999 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.0800000000000001 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.46 113.745 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 4.8200000000000003 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.9800000000000004 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.25 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 2.8799999999999999 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.0999999999999996 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 3.73 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 2.9700000000000002 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 2.79 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.1499999999999999 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.46 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.543 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.3999999999999999 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 3.4399999999999999 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . 0.44 ' O ' HG23 ' C' ' 10' ' ' VAL . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.6600000000000001 110.509 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.2999999999999998 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.1099999999999999 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . 0.438 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.3399999999999999 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.3300000000000001 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.2400000000000002 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . 0.41 ' HB ' HD21 ' C' ' 22' ' ' LEU . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.1400000000000001 110.637 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.631 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 1.99 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.7599999999999998 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.3500000000000001 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.3399999999999999 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 1.99 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.0 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 2.77 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.438 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.3599999999999999 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 2.9900000000000002 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.2599999999999998 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.0300000000000002 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.73 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.6200000000000001 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . 0.444 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.29 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 5.8300000000000001 110.619 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 4.5199999999999996 110.626 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.0 109.913 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 CA-C-O 120.809 0.116 . . . . 3.5699999999999998 113.267 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.462 HD12 ' HD2' ' A' ' 8' ' ' ARG . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 4.6799999999999997 110.679 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.27 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.462 ' HD2' HD12 ' A' ' 6' ' ' ILE . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.4500000000000002 109.936 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 2.8900000000000001 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG22 ' H ' ' B' ' 32' ' ' ASP . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 2.9399999999999999 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.4400000000000004 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.6099999999999999 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.3499999999999996 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.0899999999999999 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 3.6099999999999999 110.383 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.3300000000000001 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.4100000000000001 110.927 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.1499999999999999 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.71 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.494 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 3.73 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.3099999999999996 110.452 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 3.5800000000000001 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 2.9500000000000002 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 3.8700000000000001 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.0899999999999999 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.4900000000000002 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.7400000000000002 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.1100000000000003 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 4.9900000000000002 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.1699999999999999 110.614 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.1200000000000001 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 2.9500000000000002 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 2.9500000000000002 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.5099999999999998 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.75 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.1299999999999999 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.1800000000000002 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.6800000000000002 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.2800000000000002 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.1699999999999999 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 2.9100000000000001 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.2599999999999998 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.1000000000000001 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.4399999999999999 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.3899999999999997 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.1399999999999997 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.4199999999999999 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 4.54 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.0199999999999996 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 6.6799999999999997 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.4699999999999998 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 5.7699999999999996 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m . . . . . 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.5499999999999998 110.12 -178.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.1100000000000003 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.25 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 3.3199999999999998 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.4699999999999998 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.3999999999999999 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 3.48 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . 0.478 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.5199999999999996 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.481 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.8899999999999997 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 3.8199999999999998 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.7000000000000002 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.478 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 3.7799999999999998 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.0 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 2.9100000000000001 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.4399999999999999 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.5699999999999998 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.2800000000000002 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.7400000000000002 111.227 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 3.6499999999999999 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 3.98 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 4.7999999999999998 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.4100000000000001 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 4.8499999999999996 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 3.6899999999999999 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.0099999999999998 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.4299999999999997 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.489 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.5599999999999996 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.498 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.4699999999999998 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 1.98 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.3999999999999999 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.0 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.5 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.3899999999999997 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 42' ' ' LYS . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.6000000000000001 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.7400000000000002 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.3799999999999999 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 3.7599999999999998 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.3499999999999996 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.4199999999999999 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 2.6899999999999999 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.3599999999999999 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.21 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 3.6600000000000001 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.2000000000000002 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.0999999999999996 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 3.8100000000000001 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.2000000000000002 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.1900000000000004 109.812 179.322 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.591 -0.151 . . . . 5.0099999999999998 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.25 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.4700000000000002 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 3.96 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.5299999999999998 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 3.6000000000000001 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 2.6400000000000001 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.567 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 2.7000000000000002 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . 0.691 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.5699999999999998 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.3900000000000001 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . 0.585 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.1600000000000001 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.691 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.0499999999999998 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 2.6400000000000001 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.4399999999999999 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.3399999999999999 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.6600000000000001 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.46 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.1799999999999997 109.537 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.5299999999999998 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.2199999999999998 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.04 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.0199999999999996 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.0800000000000001 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.4699999999999998 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 3.6899999999999999 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.5800000000000001 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.1399999999999997 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.8199999999999998 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.2599999999999998 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 2.6600000000000001 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.25 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.2400000000000002 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . 0.418 ' HA ' ' O ' ' D' ' 3' ' ' SER . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.3999999999999999 108.763 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . 0.478 HG22 ' HB2' ' D' ' 3' ' ' SER . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 2.5499999999999998 111.883 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.1400000000000001 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 2.96 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.3199999999999998 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.27 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.4399999999999999 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . 0.483 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.02 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 2.96 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.2000000000000002 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.2400000000000002 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 3.7200000000000002 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.0099999999999998 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 5.6200000000000001 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.1200000000000001 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.3099999999999996 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 3.6899999999999999 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . 0.542 ' H ' HD12 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.5699999999999998 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.478 ' HB2' HG22 ' C' ' 38' ' ' VAL . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.6400000000000001 111.87 -178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.4399999999999999 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.9199999999999999 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . 0.542 HD12 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.4500000000000002 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.6099999999999999 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.77 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . 0.419 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.1499999999999999 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.797 HG13 ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.0800000000000001 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . 0.797 ' H ' HG13 ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.5899999999999999 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.494 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.0599999999999996 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.414 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 4.8399999999999999 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.4300000000000002 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.5099999999999998 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 2.75 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' C' ' 15' ' ' ARG . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.3599999999999999 110.788 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . 0.46 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.0800000000000001 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . 0.427 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.46 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 4.8200000000000003 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . 0.494 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.9800000000000004 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.25 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . 0.585 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 2.8799999999999999 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.0999999999999996 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 3.73 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 2.9700000000000002 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 2.79 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.1499999999999999 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.46 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.505 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.3999999999999999 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 3.4399999999999999 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.6600000000000001 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.2999999999999998 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.471 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.1099999999999999 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.3399999999999999 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.3300000000000001 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.1400000000000001 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 1.99 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.7599999999999998 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.3500000000000001 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.483 ' CB ' ' HB3' ' C' ' 46' ' ' LYS . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.3399999999999999 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.0 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 2.77 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.3599999999999999 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 2.9900000000000002 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.2599999999999998 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.0300000000000002 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . 0.408 ' HB2' ' SD ' ' D' ' 52' ' ' MET . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.73 111.258 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.6200000000000001 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' D' ' 50' ' ' PRO . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.29 110.33 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 5.8300000000000001 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 4.5199999999999996 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.0 110.153 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 N-CA-C 111.978 -0.449 . . . . 3.5699999999999998 111.978 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 4.6799999999999997 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.27 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.4500000000000002 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 2.8900000000000001 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 2.9399999999999999 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.4400000000000004 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' B' ' 23' ' ' ARG . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.6099999999999999 110.941 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.3499999999999996 110.68 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.0899999999999999 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.455 ' HG2' HG22 ' B' ' 17' ' ' VAL . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 3.6099999999999999 112.014 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.541 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.3300000000000001 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.44 ' HA ' ' HG2' ' B' ' 15' ' ' ARG . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.4100000000000001 112.172 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.515 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.1499999999999999 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HG2' HG11 ' B' ' 38' ' ' VAL . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.71 112.421 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 3.73 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.3099999999999996 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.429 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 3.5800000000000001 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 2.9500000000000002 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 3.8700000000000001 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.0899999999999999 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.4900000000000002 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.7400000000000002 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.1100000000000003 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 4.9900000000000002 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.1699999999999999 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.1200000000000001 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB1' ' HB ' ' B' ' 7' ' ' VAL . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 2.9500000000000002 111.174 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.426 ' HB2' ' HB3' ' B' ' 8' ' ' ARG . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 2.9500000000000002 109.846 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.5099999999999998 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' B' ' 8' ' ' ARG . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.75 110.629 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.1299999999999999 109.347 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.1800000000000002 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.406 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.6800000000000002 109.314 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.2800000000000002 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.1699999999999999 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 2.9100000000000001 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' B' ' 45' ' ' LEU . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.2599999999999998 109.84 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.1000000000000001 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.4399999999999999 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.3899999999999997 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HB2' ' HB2' ' B' ' 41' ' ' GLU . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.1399999999999997 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.4199999999999999 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 4.54 110.228 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.0199999999999996 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 6.6799999999999997 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.4699999999999998 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 5.7699999999999996 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.5499999999999998 110.222 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 112.297 -0.321 . . . . 4.1100000000000003 112.297 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.25 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.412 ' HB ' ' HB1' ' A' ' 33' ' ' ALA . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 3.3199999999999998 110.868 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.556 ' HB2' HD11 ' A' ' 36' ' ' ILE . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.4699999999999998 109.662 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.3999999999999999 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' VAL . . . . . 0.484 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 3.48 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.5199999999999996 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.8899999999999997 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' B' ' 13' ' ' LEU . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 3.8199999999999998 109.846 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.7000000000000002 114.105 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.515 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 3.7799999999999998 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.541 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.0 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.455 HG22 ' HG2' ' A' ' 15' ' ' ARG . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 2.9100000000000001 110.841 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.4399999999999999 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . 0.471 ' HD2' HG23 ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.5699999999999998 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ILE . . . . . 0.41 ' H ' HG13 ' B' ' 20' ' ' ILE . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.2800000000000002 111.34 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.7400000000000002 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' LEU . . . . . 0.401 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 3.6499999999999999 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.444 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 3.98 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 4.7999999999999998 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.4100000000000001 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 4.8499999999999996 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 3.6899999999999999 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.0099999999999998 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.4299999999999997 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.5599999999999996 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.4699999999999998 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 1.98 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' B' ' 45' ' ' LEU . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.3999999999999999 110.042 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.0 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.5 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.3899999999999997 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.454 HG11 ' HG2' ' A' ' 19' ' ' PRO . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.6000000000000001 110.813 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.446 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.7400000000000002 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.3799999999999999 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 3.7599999999999998 110.554 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.3499999999999996 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.4199999999999999 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 2.6899999999999999 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.419 ' HB3' HD21 ' B' ' 34' ' ' LEU . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.3599999999999999 108.33 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.21 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 3.6600000000000001 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' TYR . . . . . 0.44 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.2000000000000002 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.0999999999999996 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 3.8100000000000001 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.2000000000000002 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.1900000000000004 110.454 -179.593 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.579 0.585 . . . . 5.0099999999999998 112.579 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.25 109.763 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.4700000000000002 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 3.96 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.5299999999999998 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 3.6000000000000001 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 2.6400000000000001 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 2.7000000000000002 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.5699999999999998 108.671 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 13' ' ' LEU . . . . . 0.844 HD11 ' HA ' ' D' ' 20' ' ' ILE . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.3900000000000001 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.1600000000000001 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . 0.526 ' CZ ' ' HB3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.0499999999999998 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 16' ' ' VAL . . . . . 0.543 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 2.6400000000000001 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 17' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.4399999999999999 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.3399999999999999 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.6600000000000001 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.46 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.1799999999999997 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 22' ' ' LEU . . . . . 0.665 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.5299999999999998 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 23' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.2199999999999998 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.04 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.0199999999999996 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.0800000000000001 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.4699999999999998 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 3.6899999999999999 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.5800000000000001 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.1399999999999997 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.8199999999999998 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.2599999999999998 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 2.6600000000000001 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 35' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.25 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.2400000000000002 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.3999999999999999 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 38' ' ' VAL . . . . . 0.48 HG13 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 2.5499999999999998 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.1400000000000001 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 2.96 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 43' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.3199999999999998 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.27 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.4399999999999999 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.02 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 2.96 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 48' ' ' TYR . . . . . 0.551 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.2000000000000002 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.2400000000000002 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 3.7200000000000002 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.0099999999999998 110.189 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 5.6200000000000001 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 54' ' ' CYS . . . . . 0.419 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.1200000000000001 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.3099999999999996 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 1' ' ' MET . . . . . 0.431 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 3.6899999999999999 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.5699999999999998 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 3' ' ' SER . . . . . 0.48 ' CB ' HG13 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.6400000000000001 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.4399999999999999 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.9199999999999999 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.4500000000000002 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 7' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.6099999999999999 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 8' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.77 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 9' ' ' LYS . . . . . 0.436 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.1499999999999999 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 10' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.0800000000000001 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.5899999999999999 109.93 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 12' ' ' GLU . . . . . 0.43 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.0599999999999996 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 13' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' D' ' 13' ' ' LEU . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 4.8399999999999999 109.6 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.4300000000000002 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.534 ' HA ' ' HA ' ' C' ' 17' ' ' VAL . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.5099999999999998 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 16' ' ' VAL . . . . . 0.543 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 2.75 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 17' ' ' VAL . . . . . 0.441 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.3599999999999999 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.0800000000000001 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 19' ' ' PRO . . . . . 0.448 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.46 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 20' ' ' ILE . . . . . 0.844 ' HA ' HD11 ' C' ' 13' ' ' LEU . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 4.8200000000000003 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.9800000000000004 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 22' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.25 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 2.8799999999999999 111.682 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 24' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.0999999999999996 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 3.73 110.296 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 2.9700000000000002 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 2.79 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.1499999999999999 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.46 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 30' ' ' GLU . . . . . 0.554 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.3999999999999999 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 3.4399999999999999 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.6600000000000001 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.1099999999999999 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.3399999999999999 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.3300000000000001 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.2400000000000002 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.1400000000000001 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 1.99 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.7599999999999998 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 41' ' ' GLU . . . . . 0.646 ' HA ' HD22 ' C' ' 26' ' ' LEU . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.3500000000000001 111.382 -179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.3399999999999999 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 1.99 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 45' ' ' LEU . . . . . 0.519 HD23 HG11 ' C' ' 16' ' ' VAL . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 2.77 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.3599999999999999 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 2.9900000000000002 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.2599999999999998 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 49' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.0300000000000002 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 50' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.73 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.6200000000000001 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.29 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 5.8300000000000001 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 4.5199999999999996 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.0 110.197 -179.019 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 tpt . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.743 0.306 . . . . 9.4199999999999999 110.336 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 37.7 mmtt -140.14 -171.49 3.2 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.124 -0.489 . . . . 10.67 109.971 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -73.02 88.2 1.39 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.979 0.418 . . . . 7.75 110.548 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -159.67 153.73 23.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.066 -0.515 . . . . 5.6600000000000001 110.39 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -144.77 -151.25 5.39 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.957 -0.639 . . . . 3.5699999999999998 111.901 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 36' ' ' ILE . 51.5 mt -82.39 127.5 39.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 110.279 -0.267 . . . . 4.6799999999999997 110.279 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -78.81 113.47 18.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.259 0.552 . . . . 3.27 110.439 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -110.57 134.86 52.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.107 -0.497 . . . . 4.4500000000000002 111.278 -179.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.49 119.19 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.692 -0.686 . . . . 2.8900000000000001 109.54 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 15' ' ' ARG . 35.8 m -112.16 -157.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.375 -0.602 . . . . 2.9399999999999999 109.375 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 14' ' ' GLY . 10.4 t0 -79.81 139.91 37.04 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.977 -0.379 . . . . 4.4400000000000004 109.977 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.16 -2.14 20.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.322 -0.399 . . . . 3.6099999999999999 111.692 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 tp -120.02 3.29 10.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.999 0.428 . . . . 4.3499999999999996 110.184 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 11' ' ' ASP . . . 140.33 -131.88 5.24 Favored Glycine 0 C--O 1.224 -0.477 0 CA-C-N 116.103 -0.498 . . . . 2.0899999999999999 111.934 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER 44.92 83.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.273 0.629 . . . . 3.6099999999999999 112.603 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -79.87 84.3 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.573 0.702 . . . . 2.3300000000000001 109.89 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.53 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 4.3 m -84.99 103.64 12.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.455 -0.793 . . . . 2.4100000000000001 110.514 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -59.92 154.93 45.96 Favored Pre-proline 0 C--O 1.236 0.388 0 CA-C-N 115.762 -0.654 . . . . 3.1499999999999999 111.033 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HG2' HG21 ' B' ' 36' ' ' ILE . 83.8 Cg_exo -44.25 124.17 4.85 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 123.39 2.726 . . . . 2.71 113.449 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.497 ' H ' HG13 ' A' ' 20' ' ' ILE . 3.5 mt -63.21 -34.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.364 -0.835 . . . . 3.73 109.655 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' D' ' 21' ' ' GLU . 3.7 pm0 -58.12 -51.39 69.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.871 -1.059 . . . . 4.3099999999999996 110.875 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.452 ' H ' ' HG2' ' A' ' 21' ' ' GLU . 41.9 tp -68.56 -34.58 76.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.882 0.372 . . . . 3.5800000000000001 110.527 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.543 ' NH2' ' HA3' ' B' ' 14' ' ' GLY . 70.0 mtp180 -56.37 -47.97 77.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.768 -0.651 . . . . 2.9500000000000002 111.566 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 55.6 mtm-85 -84.69 -31.05 24.31 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.868 0.321 . . . . 3.8700000000000001 111.868 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.43 HG23 ' HG3' ' D' ' 2' ' ' LYS . 57.8 m -65.57 -48.03 73.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.731 0.301 . . . . 4.0899999999999999 111.035 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 tt -85.63 -28.07 25.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.259 -0.428 . . . . 4.4900000000000002 110.687 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.86 58.81 2.58 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.065 -1.064 . . . . 3.7400000000000002 110.828 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.4 mt -91.51 106.83 18.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.449 -0.375 . . . . 4.1100000000000003 110.726 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 119.8 13.07 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.864 -0.421 . . . . 4.9900000000000002 109.864 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -93.29 53.85 2.0 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.205 0.526 . . . . 6.1699999999999999 111.671 -178.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -136.17 10.45 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 4.1200000000000001 111.272 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.527 ' O ' HG22 ' B' ' 10' ' ' VAL . 0.7 OUTLIER -126.35 -164.72 1.36 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.613 -0.267 . . . . 3.98 110.454 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -105.12 136.03 45.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.002 0.43 . . . . 2.9500000000000002 111.437 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.9 142.05 46.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.881 -0.6 . . . . 2.9500000000000002 110.168 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -72.17 131.52 42.9 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.144 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' B' ' 8' ' ' ARG . 69.8 mt -129.25 103.49 9.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.908 -0.587 . . . . 2.75 110.002 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -104.06 129.21 51.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.291 -0.413 . . . . 6.1299999999999999 110.174 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.5 t -91.0 123.95 43.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.794 0.331 . . . . 3.1800000000000002 110.831 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 32.8 t70 -127.09 89.72 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 3.6800000000000002 110.295 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.8 -83.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.336 -0.847 . . . . 4.2800000000000002 111.894 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.29 7.41 5.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.857 0.36 . . . . 3.1699999999999999 111.082 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 8.0 ptpp? -123.38 151.2 42.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.684 -0.487 . . . . 2.9100000000000001 109.684 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.2 pt -124.27 129.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.996 0.427 . . . . 2.2599999999999998 110.538 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.55 110.22 22.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.951 -0.568 . . . . 3.1000000000000001 110.291 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.562 HD22 HD11 ' B' ' 45' ' ' LEU . 7.6 mp -102.49 120.71 40.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.638 -0.71 . . . . 2.4399999999999999 110.175 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -157.61 175.26 14.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.749 0.309 . . . . 5.3899999999999997 110.732 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 50' ' ' PRO . 37.5 mttm -101.34 177.69 4.86 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.969 -0.752 . . . . 4.1399999999999997 108.969 178.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -57.72 -42.36 83.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.006 0.431 . . . . 5.4199999999999999 111.038 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 47.0 tptt -160.05 81.51 2.35 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.043 -0.526 . . . . 4.54 109.994 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.406 ' HG3' ' H ' ' A' ' 47' ' ' LYS . 1.3 Cg_endo -80.08 -7.2 14.19 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.826 2.35 . . . . 5.0199999999999996 112.329 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB2' ' HG2' ' B' ' 41' ' ' GLU . 32.8 t30 -98.4 14.83 26.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.245 0.545 . . . . 6.6799999999999997 110.351 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.8 ttt -150.93 35.47 0.6 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.441 0.638 . . . . 6.4699999999999998 109.716 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.86 -59.22 1.91 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.301 -0.863 . . . . 5.7699999999999996 110.68 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.13 -10.12 26.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.144 -0.48 . . . . 4.5499999999999998 110.424 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 6.7999999999999998 110.264 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.577 0.703 . . . . 10.279999999999999 109.547 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -92.47 -156.55 0.47 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.998 -1.001 . . . . 9.0299999999999994 109.63 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m -86.18 64.88 8.81 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.049 -0.352 . . . . 6.5800000000000001 110.049 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -33.63 56.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.311 -0.404 . . . . 5.3399999999999999 111.503 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.12 124.54 1.31 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.85 -0.691 . . . . 4.1100000000000003 111.463 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.676 HG23 ' H ' ' B' ' 7' ' ' VAL . 8.1 tt 175.12 -66.21 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.682 0.241 . . . . 4.25 111.146 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.676 ' H ' HG23 ' B' ' 6' ' ' ILE . 14.6 p -166.81 146.65 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.313 -0.255 . . . . 3.3199999999999998 110.313 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' NH2' HG13 ' B' ' 20' ' ' ILE . 3.5 mtt180 -149.72 152.15 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.139 -0.319 . . . . 4.4699999999999998 110.139 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -76.56 138.35 40.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.062 0.458 . . . . 3.3999999999999999 110.85 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 32' ' ' ASP . 18.0 m -85.55 143.35 11.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.688 -0.856 . . . . 3.48 108.688 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -64.31 149.43 48.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.352 -0.386 . . . . 4.5199999999999996 111.174 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -60.86 -16.56 42.87 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.776 -0.647 . . . . 4.8899999999999997 111.983 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 13' ' ' LEU . 3.9 mm? -91.37 5.63 48.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 3.8199999999999998 110.376 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . 0.543 ' HA3' ' NH2' ' A' ' 23' ' ' ARG . . . 77.91 50.55 6.34 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.987 -0.625 . . . . 2.7000000000000002 112.203 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -134.34 129.3 35.28 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.329 -0.248 . . . . 3.7799999999999998 110.329 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.45 HG11 HD21 ' A' ' 45' ' ' LEU . 6.3 t -92.34 139.09 18.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.096 -1.075 . . . . 3.0 108.096 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG11 ' OP2' ' E' ' 7' ' ' ' DG' . 7.9 m -121.73 150.11 24.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.428 0.632 . . . . 2.9100000000000001 112.247 -178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 43.9 mm -80.48 135.32 53.47 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 114.702 -1.135 . . . . 2.4399999999999999 109.422 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.74 132.69 26.4 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.916 2.41 . . . . 2.5699999999999998 112.103 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.484 HG13 ' NH2' ' B' ' 8' ' ' ARG . 2.6 mt -53.38 -53.31 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 CA-C-N 115.869 -0.605 . . . . 4.2800000000000002 111.596 -178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.57 -34.67 62.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.61 -0.723 . . . . 4.7400000000000002 112.364 -179.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 56.6 tp -69.34 -56.34 7.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.663 0.268 . . . . 3.6499999999999999 111.241 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -32.41 71.57 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.604 0.594 . . . . 3.98 112.604 -178.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -73.24 -25.09 60.59 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.838 0.31 . . . . 4.7999999999999998 111.838 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -99.2 -45.52 5.87 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.823 -0.351 . . . . 4.4100000000000001 111.888 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.27 103.84 6.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.963 0.411 . . . . 4.8499999999999996 112.085 -178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.24 56.09 5.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.877 -0.889 . . . . 3.6899999999999999 110.877 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 15.4 pt -88.23 7.25 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 112.169 0.433 . . . . 4.0099999999999998 112.169 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -141.74 110.31 6.06 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.483 -0.326 . . . . 4.4299999999999997 110.364 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -72.88 171.92 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.125 0.488 . . . . 5.5599999999999996 111.136 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.84 122.89 23.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.773 -0.649 . . . . 4.4699999999999998 111.043 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 175.41 -57.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.68 -0.691 . . . . 3.96 109.335 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.04 150.46 44.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.624 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.0 mt -148.84 155.89 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.638 -0.256 . . . . 2.3999999999999999 110.5 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -92.7 123.82 36.27 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.707 -0.479 . . . . 3.0 109.707 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.542 HG21 ' HG2' ' A' ' 19' ' ' PRO . 25.0 mm -93.28 113.45 28.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.012 -0.54 . . . . 2.5 111.808 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.489 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 75.6 m-85 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.032 -0.729 . . . . 4.3899999999999997 109.032 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -78.0 90.37 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.301 0.572 . . . . 3.6000000000000001 109.514 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -91.22 77.26 5.96 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.974 -0.557 . . . . 4.7400000000000002 110.47 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 19.2 t70 66.03 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.126 -0.943 . . . . 5.3799999999999999 112.23 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.407 ' HG2' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -122.22 -5.49 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.214 0.45 . . . . 3.7599999999999998 112.214 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -114.42 137.75 51.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.042 0.448 . . . . 4.3499999999999996 110.698 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mt -100.67 99.75 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.61 -0.723 . . . . 2.4199999999999999 110.751 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 50.2 mt -87.8 120.82 37.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.748 -0.464 . . . . 2.6899999999999999 109.748 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.562 HD11 HD22 ' A' ' 45' ' ' LEU . 13.4 mt -102.62 120.02 39.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.555 -0.293 . . . . 2.3599999999999999 110.715 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.426 ' HG2' ' H ' ' B' ' 47' ' ' LYS . 35.6 tttm -112.05 173.41 6.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.244 -0.435 . . . . 3.21 110.024 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.426 ' H ' ' HG2' ' B' ' 46' ' ' LYS . 52.5 mtpt -55.47 152.08 9.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.041 0.448 . . . . 3.6600000000000001 111.677 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -61.2 141.68 57.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.79 -0.641 . . . . 5.2000000000000002 112.234 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -134.5 155.52 79.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.326 -0.852 . . . . 5.0999999999999996 109.099 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.8 -71.83 0.03 OUTLIER 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.198 1.932 . . . . 3.8100000000000001 111.648 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 55.6 t30 44.02 53.88 6.17 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.445 0.64 . . . . 5.2000000000000002 111.618 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.59 123.55 27.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.563 -0.744 . . . . 6.1900000000000004 110.329 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.52 -36.1 13.92 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 5.4199999999999999 111.472 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 18.4 t -155.34 161.09 41.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 5.5199999999999996 110.041 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' D' ' 55' ' ' GLN . 27.7 mt-30 . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.411 -0.359 . . . . 6.3799999999999999 110.488 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 82.0 mmm . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.298 0.571 . . . . 7.7999999999999998 110.398 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -61.13 123.99 19.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.438 -0.801 . . . . 8.5700000000000003 111.246 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . 0.424 ' HB2' ' HB3' ' C' ' 19' ' ' PRO . 1.8 m -127.14 26.52 6.05 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.399 -0.819 . . . . 5.0099999999999998 109.069 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . 0.54 HG23 HG12 ' D' ' 38' ' ' VAL . 2.1 m -59.55 103.13 0.17 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.018 -0.992 . . . . 4.25 110.354 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.8 53.45 2.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.661 -0.976 . . . . 2.4700000000000002 110.661 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 17.7 tt -106.59 139.64 27.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.006 0.431 . . . . 3.96 110.964 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 26.4 t -94.25 109.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.165 -0.47 . . . . 2.5299999999999998 109.878 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.27 133.73 36.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.95 -0.568 . . . . 3.6000000000000001 109.83 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -80.79 141.58 34.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.161 0.505 . . . . 2.6400000000000001 110.94 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 46.1 t -104.57 113.18 40.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.784 -0.644 . . . . 2.7000000000000002 109.495 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.34 -158.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.867 -0.42 . . . . 3.5699999999999998 109.867 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.03 79.79 0.66 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.836 0.351 . . . . 3.21 110.52 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.517 ' HG ' ' H41' ' F' ' 9' ' ' ' DC' . 0.7 OUTLIER -145.25 -105.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.164 0.507 . . . . 3.3900000000000001 111.037 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.98 -32.12 0.61 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.746 -0.942 . . . . 3.1600000000000001 110.746 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.55 HH11 HG22 ' D' ' 17' ' ' VAL . 30.1 ptt180 -118.63 164.93 14.61 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.289 -0.634 . . . . 5.0499999999999998 109.289 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 10.3 m -131.64 -162.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.502 -0.479 . . . . 2.6400000000000001 111.86 -178.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 1.6 m -128.28 178.25 5.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.079 0.466 . . . . 3.4399999999999999 111.362 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.9 mt -117.48 135.02 23.09 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.55 -0.75 . . . . 3.3399999999999999 109.048 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . 0.424 ' HB3' ' HB2' ' C' ' 3' ' ' SER . 88.6 Cg_exo -48.87 145.08 13.91 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.862 2.375 . . . . 2.6600000000000001 112.579 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 tt -53.5 -44.68 56.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.129 -0.487 . . . . 4.46 112.219 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' C' ' 22' ' ' LEU . 0.2 OUTLIER -63.91 -40.59 96.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.735 0.302 . . . . 4.1799999999999997 111.147 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 2.4 mp -70.27 -42.26 72.37 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.673 -0.491 . . . . 3.5299999999999998 109.673 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' C' ' 26' ' ' LEU . 35.1 ttt180 -58.95 -43.65 91.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.28 -0.873 . . . . 4.2199999999999998 110.805 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.98 -39.2 79.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 5.04 110.922 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -70.28 -30.46 67.49 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.213 -0.449 . . . . 4.29 111.455 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 65.2 mt -55.27 -42.42 73.52 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.756 0.313 . . . . 5.0199999999999996 111.046 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 66.69 42.13 93.44 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.867 -0.682 . . . . 4.0800000000000001 112.137 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 46.1 pt -119.16 -179.88 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.822 0.344 . . . . 4.4699999999999998 110.213 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.39 169.94 11.82 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.668 -0.493 . . . . 3.6899999999999999 109.668 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.453 ' O ' ' HB ' ' D' ' 10' ' ' VAL . 5.9 mm-40 -68.32 -44.78 74.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.254 -0.647 . . . . 5.5800000000000001 109.254 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -102.28 38.95 1.57 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.55 -0.75 . . . . 5.1399999999999997 110.25 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . 0.468 ' O ' HG23 ' D' ' 10' ' ' VAL . 1.4 t0 -78.04 -161.59 0.27 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.215 -0.448 . . . . 2.8199999999999998 110.749 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . 0.524 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -132.53 134.73 45.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.31 -0.404 . . . . 2.2599999999999998 110.809 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 73.3 mt -111.2 134.79 52.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.298 -0.41 . . . . 2.6600000000000001 110.258 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -80.02 105.92 11.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.418 . . . . 2.25 109.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 9.0 mt -88.15 120.46 37.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.992 -0.549 . . . . 2.2400000000000002 111.32 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.522 ' HA ' ' O ' ' D' ' 3' ' ' SER . 26.2 t80 -134.41 148.59 50.67 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 108.856 -0.794 . . . . 2.3999999999999999 108.856 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . 0.535 HG13 ' HB2' ' D' ' 3' ' ' SER . 0.0 OUTLIER -97.19 164.56 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 112.627 0.603 . . . . 2.5499999999999998 112.627 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -149.39 85.8 1.46 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 114.988 -1.006 . . . . 2.29 109.531 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 32.1 t70 69.68 -77.16 0.05 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.617 -0.72 . . . . 3.0 110.272 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -139.9 3.89 2.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.528 0.68 . . . . 3.1400000000000001 109.273 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -107.05 177.82 4.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.942 -1.026 . . . . 2.96 109.032 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 21.4 mt -131.64 137.95 54.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.131 0.491 . . . . 2.3199999999999998 111.672 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 81.6 mt -115.81 110.55 32.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 108.765 -0.828 . . . . 2.27 108.765 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 4.8 mp -103.65 117.73 35.07 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.034 0.445 . . . . 2.4399999999999999 110.405 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -99.05 -175.96 3.18 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.67 -0.695 . . . . 3.02 109.923 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -76.28 -174.23 2.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.847 0.356 . . . . 2.96 111.078 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -60.34 144.99 49.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.785 -0.643 . . . . 4.2000000000000002 111.584 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -160.05 142.9 10.04 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.464 -0.789 . . . . 3.2400000000000002 109.584 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.47 64.66 5.55 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.35 2.033 . . . . 3.5 112.186 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -115.64 108.38 16.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.173 -0.467 . . . . 3.7200000000000002 110.069 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . 0.403 ' HB3' ' HB3' ' C' ' 55' ' ' GLN . 6.2 tmm? -114.49 158.43 21.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.135 -0.484 . . . . 6.0099999999999998 110.007 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.12 129.32 39.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.243 -0.435 . . . . 5.6200000000000001 110.968 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 m 64.3 31.07 13.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.053 -0.521 . . . . 4.1200000000000001 110.445 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . 0.403 ' HB3' ' HB3' ' C' ' 52' ' ' MET . 6.8 tp-100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.943 -0.571 . . . . 5.3099999999999996 110.492 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.883 0.373 . . . . 3.6899999999999999 110.607 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . 0.43 ' HG3' HG23 ' A' ' 25' ' ' THR . 46.6 mmtt -82.51 166.29 19.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.188 -0.46 . . . . 3.5699999999999998 110.509 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.535 ' HB2' HG13 ' C' ' 38' ' ' VAL . 5.1 m -86.58 45.83 1.29 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.277 0.56 . . . . 2.6400000000000001 111.171 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -91.91 24.17 3.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.212 0.53 . . . . 2.4399999999999999 110.2 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.44 44.31 5.6 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.307 -1.117 . . . . 1.9199999999999999 110.307 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mt -117.19 138.85 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.857 0.36 . . . . 2.4500000000000002 110.762 -178.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 35.6 m -89.02 150.16 3.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.313 -0.403 . . . . 2.6099999999999999 111.36 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' C' ' 33' ' ' ALA . 3.3 ttt-85 -143.61 151.27 39.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.182 -0.463 . . . . 2.77 110.19 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -63.14 145.12 56.17 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.887 0.742 . . . . 3.1499999999999999 111.207 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.571 HG12 ' H ' ' D' ' 15' ' ' ARG . 10.9 t -84.4 -95.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 115.807 -0.633 . . . . 3.0800000000000001 110.814 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -174.04 157.68 2.95 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.35 -0.219 . . . . 4.5899999999999999 110.839 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.65 -31.58 68.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.367 -0.378 . . . . 6.0599999999999996 111.012 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.469 ' HB2' HH22 ' D' ' 15' ' ' ARG . 2.1 mm? -111.21 8.71 21.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 4.8399999999999999 110.765 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.5 93.33 0.21 Allowed Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.837 -0.697 . . . . 3.4300000000000002 113.038 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.571 ' H ' HG12 ' D' ' 10' ' ' VAL . 12.5 ttm105 -152.15 121.61 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.33 -0.618 . . . . 4.5099999999999998 109.33 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' C' ' 15' ' ' ARG . 3.1 p -73.37 110.77 7.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.724 0.773 . . . . 2.75 110.32 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.55 HG22 HH11 ' C' ' 15' ' ' ARG . 23.5 t -75.7 120.77 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.442 -1.253 . . . . 3.3599999999999999 111.083 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 69.1 mt -99.43 110.56 58.88 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.852 -0.613 . . . . 3.0800000000000001 109.778 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.76 151.0 50.43 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.807 2.338 . . . . 3.46 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.494 ' H ' HD12 ' D' ' 20' ' ' ILE . 1.4 mp -47.85 -56.98 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.29 -0.868 . . . . 4.8200000000000003 111.523 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 2.2 mp0 -59.07 -38.91 80.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.76 -0.655 . . . . 4.9800000000000004 112.043 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.52 -42.46 92.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.733 0.301 . . . . 3.25 110.314 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -61.79 -40.78 96.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.318 0.58 . . . . 2.8799999999999999 109.68 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -71.78 -32.26 67.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.269 -0.878 . . . . 6.0999999999999996 110.915 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 69.3 m -67.45 -42.34 83.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.82 0.343 . . . . 3.73 110.077 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.93 -29.91 69.9 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.065 -0.516 . . . . 2.9700000000000002 110.316 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.26 24.76 60.62 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.827 -0.624 . . . . 2.79 112.063 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 pt -92.5 143.58 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.232 0.539 . . . . 2.1499999999999999 111.394 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.82 -177.08 3.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.446 -0.797 . . . . 2.46 110.369 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -81.78 21.73 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.447 0.642 . . . . 3.3999999999999999 110.727 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -148.67 30.41 0.82 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.426 -0.806 . . . . 3.4399999999999999 109.151 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.98 -158.9 0.69 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 2.6600000000000001 111.459 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.34 44.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.233 -0.44 . . . . 2.2999999999999998 110.518 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 mt -138.18 130.17 28.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.356 -0.384 . . . . 2.1099999999999999 110.048 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 31.0 tt0 -92.7 118.5 31.12 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.836 -0.431 . . . . 2.3399999999999999 109.836 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 8.6 mt -99.94 110.83 27.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.713 -0.676 . . . . 2.3300000000000001 111.167 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -118.46 177.75 4.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.624 -0.88 . . . . 2.2400000000000002 108.624 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . 0.54 HG12 HG23 ' C' ' 4' ' ' THR . 5.0 p -142.29 139.0 29.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 120.888 0.375 . . . . 2.1400000000000001 110.777 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.478 ' O ' ' HE3' ' D' ' 42' ' ' LYS . 20.5 t70 -119.93 102.39 8.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.452 -0.944 . . . . 1.99 108.452 178.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' D' ' 39' ' ' ASP . 73.2 m-20 69.44 -86.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.453 0.47 . . . . 2.7599999999999998 110.0 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -138.2 16.62 2.79 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.51 -0.314 . . . . 2.3500000000000001 110.533 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' D' ' 39' ' ' ASP . 1.6 ptpt -115.83 148.93 39.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.64 0.257 . . . . 2.3399999999999999 110.675 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . 0.496 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 9.7 mt -85.89 123.42 39.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.313 -0.403 . . . . 1.99 110.996 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 49.8 mm -103.37 104.64 16.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.802 -0.635 . . . . 2.0 109.498 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -95.75 118.7 32.91 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.205 -0.452 . . . . 2.77 110.754 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.458 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 50.9 mtpt -110.3 140.05 44.87 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.053 -0.521 . . . . 2.3599999999999999 109.842 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.4 176.0 2.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.063 0.459 . . . . 2.9900000000000002 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.483 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 12.4 p90 -61.92 154.74 25.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.798 -0.637 . . . . 3.2599999999999998 110.521 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -92.95 107.57 25.73 Favored Pre-proline 0 C--N 1.321 -0.651 0 N-CA-C 109.681 -0.489 . . . . 5.0300000000000002 109.681 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 32.6 Cg_exo -59.3 -64.16 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.373 2.048 . . . . 3.73 111.848 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.33 21.7 8.58 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.175 0.512 . . . . 4.6200000000000001 110.842 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 ttt -160.74 140.29 10.78 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.884 -0.784 . . . . 5.29 108.884 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.5 147.46 52.79 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.573 0.225 . . . . 5.8300000000000001 110.595 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 4.6 t -67.34 108.5 2.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.074 0.464 . . . . 4.5199999999999996 110.397 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' B' ' 55' ' ' GLN . 17.3 mt-30 . . . . . 0 C--O 1.244 0.777 0 CA-C-O 118.831 -0.604 . . . . 7.0 110.11 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.676 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 O4'-C1'-C2' 106.963 0.784 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.676 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 N19-C1'-C2' 117.169 1.855 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.682 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O4'-C1'-N19 109.404 2.005 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.682 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.114 1.642 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.6 " C2'" ' H72' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-N19 109.483 2.103 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.703 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O3'-P-O5' 100.26 -1.968 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.703 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 O4'-C1'-N19 109.609 2.262 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.607 ' C8 ' " H1'" ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O3'-P-O5' 100.982 -1.588 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.549 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 O3'-P-O5' 100.249 -1.974 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.628 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.243 -1.977 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.628 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.719 2.399 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.559 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.754 0 O4'-C1'-N19 109.545 2.181 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.581 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.878 0 O3'-P-O5' 99.567 -2.333 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.581 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.797 2.497 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.531 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.811 0 O3'-P-O5' 99.489 -2.374 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.531 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.957 2.696 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.494 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.775 0 O4'-C1'-N19 109.586 2.233 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.576 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 109.573 2.216 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.729 0 O4'-C1'-N19 109.458 2.073 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.517 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.808 0 O4'-C1'-N19 109.518 2.147 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.559 2.198 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.514 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 O4'-C1'-N19 109.708 2.385 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.533 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.687 0 O3'-P-O5' 99.842 -2.188 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.639 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O3'-P-O5' 100.709 -1.732 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.639 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 N19-C1'-C2' 116.196 1.247 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.752 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C4'-C3'-C2' 102.401 -0.799 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.752 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.845 0 N19-C1'-C2' 116.84 1.65 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.603 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.498 3.372 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.457 " H2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-N19 109.703 2.378 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.457 ' H72' " H2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 99.766 -2.228 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.799 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.785 0 O3'-P-O5' 99.372 -2.436 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.799 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 O4'-C1'-N19 109.647 2.309 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.532 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O3'-P-O5' 99.916 -2.149 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.517 ' H41' ' HG ' ' C' ' 13' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.599 2.249 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.53 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 109.366 1.957 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.419 -0.934 0 O4'-C1'-N19 109.671 2.339 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.112 0 O3'-P-O5' 99.21 -2.521 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.775 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.423 -0.652 0 O3'-P-O5' 99.722 -2.251 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.775 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -1.024 0 O4'-C1'-N19 109.892 2.615 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.703 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.838 0 O3'-P-O5' 99.607 -2.312 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.703 ' H71' H2'' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 O4'-C1'-N19 109.49 2.112 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.527 " C2'" ' H72' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O3'-P-O5' 99.495 -2.371 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.527 ' H72' " C2'" ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O3'-P-O5' 99.3 -2.474 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.791 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.803 0 N19-C1'-C2' 118.104 2.44 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.791 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 O4'-C1'-N19 109.577 2.221 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 O4'-C1'-N19 109.42 2.025 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.584 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.598 0 O3'-P-O5' 100.047 -2.08 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.696 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 O3'-P-O5' 100.461 -1.863 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.696 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O3'-P-O5' 101.31 -1.416 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.456 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.53 0.664 0 N19-C1'-C2' 116.207 1.254 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.2 ttm . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 121.059 0.457 . . . . 9.4199999999999999 110.558 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.57 136.28 2.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.863 -0.608 . . . . 10.67 109.703 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.0 m -141.45 168.97 18.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.216 -0.447 . . . . 7.75 110.068 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 m -92.42 -53.72 4.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.214 0.53 . . . . 5.6600000000000001 110.047 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -107.13 102.47 1.84 Allowed Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.987 -0.845 . . . . 3.5699999999999998 110.987 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mp -84.58 118.89 32.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.047 0.451 . . . . 4.6799999999999997 110.253 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -80.03 134.23 27.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.788 -0.642 . . . . 3.27 111.172 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -127.47 165.66 19.42 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.914 -0.773 . . . . 4.4500000000000002 108.914 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -90.99 131.27 36.69 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.578 0.228 . . . . 2.8900000000000001 111.406 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' B' ' 30' ' ' GLU . 40.7 t -90.74 87.27 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.679 -0.489 . . . . 2.9399999999999999 109.679 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.717 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 8.3 p-10 -95.4 -165.01 1.23 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.992 -0.549 . . . . 4.4400000000000004 109.947 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -85.01 -16.06 42.04 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.098 -0.241 . . . . 3.6099999999999999 111.487 -178.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.534 ' HB3' ' NH2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -104.35 -6.01 21.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.585 -0.28 . . . . 4.3499999999999996 111.442 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.81 81.26 0.09 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.129 -0.558 . . . . 2.0899999999999999 112.418 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 2.1 mmp_? -74.24 84.98 1.89 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.827 0.346 . . . . 3.6099999999999999 111.912 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.69 HG21 HG23 ' B' ' 18' ' ' ILE . 44.7 t -97.58 95.64 4.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.23 0.538 . . . . 2.3300000000000001 109.988 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.59 131.85 67.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.618 -0.719 . . . . 2.4100000000000001 110.093 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.89 127.8 85.98 Favored Pre-proline 0 C--N 1.327 -0.402 0 O-C-N 123.644 0.59 . . . . 3.1499999999999999 110.095 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.92 131.67 25.62 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.315 2.677 . . . . 2.71 113.023 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.405 HG12 H5'' ' F' ' 14' ' ' ' DA' . 9.6 tp -85.1 -25.52 6.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.063 0.459 . . . . 3.73 109.848 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.34 -52.99 61.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.418 -0.81 . . . . 4.3099999999999996 110.689 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.2 -14.71 62.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 3.5800000000000001 111.25 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' NH1' ' HG3' ' A' ' 30' ' ' GLU . 50.3 mtm180 -86.5 -29.33 22.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.005 0.431 . . . . 2.9500000000000002 110.416 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -77.76 -29.97 51.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 3.8700000000000001 110.606 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.64 -54.86 3.81 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.242 0.46 . . . . 4.0899999999999999 112.242 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.6 mt -102.23 -51.96 3.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.728 0.299 . . . . 4.4900000000000002 111.353 -178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.26 50.51 1.22 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.713 -0.756 . . . . 3.7400000000000002 111.745 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.4 pt -65.33 147.27 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.69 0.281 . . . . 4.1100000000000003 111.44 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . . . -65.0 137.24 57.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.0 -0.545 . . . . 4.9900000000000002 111.279 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.433 ' O ' HG21 ' B' ' 10' ' ' VAL . 0.1 OUTLIER -127.11 -39.01 1.95 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.541 -0.299 . . . . 6.1699999999999999 111.689 -179.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 78.9 mttt -79.08 87.94 4.84 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.307 0.484 . . . . 4.1200000000000001 112.307 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.41 -173.04 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 3.98 110.336 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -99.12 120.42 39.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.057 0.456 . . . . 2.9500000000000002 110.72 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mp -106.34 134.79 48.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.227 -0.442 . . . . 2.9500000000000002 110.488 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.513 ' HA ' ' HA ' ' B' ' 7' ' ' VAL . 8.2 pt-20 -96.34 113.64 25.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.425 0.631 . . . . 3.5099999999999998 110.238 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.9 mt -86.22 97.04 5.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.241 -0.89 . . . . 2.75 110.238 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -103.41 127.61 50.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.954 -0.567 . . . . 6.1299999999999999 109.992 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.406 HG12 HG22 ' A' ' 43' ' ' ILE . 4.3 m -82.87 140.95 15.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.933 0.397 . . . . 3.1800000000000002 110.651 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -150.46 123.57 8.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.189 -0.46 . . . . 3.6800000000000002 110.604 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.1 t70 63.98 -97.03 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.779 -0.646 . . . . 4.2800000000000002 110.589 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -133.75 12.77 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.179 0.514 . . . . 3.1699999999999999 110.495 179.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HD3' ' HG3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -134.51 178.68 6.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 2.9100000000000001 110.137 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.406 HG22 HG12 ' A' ' 38' ' ' VAL . 2.7 pt -123.59 143.88 35.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.803 0.335 . . . . 2.2599999999999998 110.568 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mt -117.72 115.99 50.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.183 -0.462 . . . . 3.1000000000000001 110.325 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mp -94.73 99.3 11.42 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.547 -0.538 . . . . 2.4399999999999999 109.547 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -88.31 139.35 30.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.917 -0.583 . . . . 5.3899999999999997 110.925 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ptmt -144.24 -169.39 3.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.641 -0.708 . . . . 4.1399999999999997 110.059 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -108.14 149.13 28.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.092 -0.336 . . . . 5.4199999999999999 110.092 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HA ' ' HD2' ' A' ' 50' ' ' PRO . 32.4 pttt -108.72 107.81 60.35 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.798 -0.445 . . . . 4.54 109.798 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HB2' ' A' ' 29' ' ' ALA . 27.1 Cg_endo -63.69 -39.58 33.98 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.53 2.153 . . . . 5.0199999999999996 112.784 -178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -113.35 110.06 19.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.11 0.481 . . . . 6.6799999999999997 110.849 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 46.3 ttp -110.43 0.79 17.98 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.734 -0.666 . . . . 6.4699999999999998 109.847 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.26 40.43 0.99 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.914 -0.585 . . . . 5.7699999999999996 110.847 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 38.2 t 67.62 87.34 0.12 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.459 -0.792 . . . . 4.5499999999999998 110.939 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.834 -0.621 . . . . 6.7999999999999998 110.168 179.589 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.0 ttt . . . . . 0 C--O 1.236 0.342 0 CA-C-O 120.439 0.161 . . . . 10.279999999999999 110.581 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 84.5 mttt 60.18 86.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.715 0.634 . . . . 9.0299999999999994 111.411 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -82.55 137.73 34.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.138 -0.483 . . . . 6.5800000000000001 110.605 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -82.14 -28.09 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.252 0.548 . . . . 5.3399999999999999 110.33 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.01 123.72 1.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 N-CA-C 111.211 -0.756 . . . . 4.1100000000000003 111.211 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 tp -133.8 126.34 50.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.053 0.454 . . . . 4.25 111.102 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 13.1 t -94.34 127.27 46.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.146 -0.479 . . . . 3.3199999999999998 109.752 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -131.44 149.25 52.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.086 0.469 . . . . 4.4699999999999998 111.557 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -99.32 140.24 33.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 3.3999999999999999 110.377 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.578 HG12 ' HB ' ' B' ' 16' ' ' VAL . 30.3 m -91.37 177.55 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.95 0.405 . . . . 3.48 110.88 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' B' ' 15' ' ' ARG . 6.1 p-10 -97.77 -161.58 0.89 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.857 -0.61 . . . . 4.5199999999999996 110.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.507 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 13.4 mm-40 -73.07 -11.19 60.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.429 0.529 . . . . 4.8899999999999997 112.429 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.42 -39.89 6.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.687 -0.405 . . . . 3.8199999999999998 110.967 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.04 44.67 0.86 Allowed Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.436 -0.888 . . . . 2.7000000000000002 113.047 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.437 ' HG2' ' OD1' ' B' ' 11' ' ' ASP . 2.4 ptt180 -118.8 128.71 54.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.78 0.324 . . . . 3.7799999999999998 110.684 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.578 ' HB ' HG12 ' B' ' 10' ' ' VAL . 8.1 p -136.06 166.52 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 120.967 0.413 . . . . 3.0 111.361 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 13' ' ' LEU . 90.9 t -108.18 141.46 23.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 115.672 -0.695 . . . . 2.9100000000000001 110.607 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.69 HG23 HG21 ' A' ' 16' ' ' VAL . 6.4 pt -108.92 171.35 4.54 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.211 -0.45 . . . . 2.4399999999999999 110.386 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' B' ' 18' ' ' ILE . 36.0 Cg_exo -58.52 103.47 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.412 2.075 . . . . 2.5699999999999998 112.149 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' B' ' 23' ' ' ARG . 1.2 pp -89.24 -1.62 9.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.068 -0.515 . . . . 4.2800000000000002 111.723 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.18 -30.86 66.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.27 0.557 . . . . 4.7400000000000002 110.028 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' B' ' 22' ' ' LEU . 2.8 mm? -68.48 -53.57 22.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.673 -0.694 . . . . 3.6499999999999999 110.483 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 20' ' ' ILE . 0.3 OUTLIER -63.17 -32.43 73.82 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 121.032 -0.267 . . . . 3.98 110.761 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -65.55 -41.23 93.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.111 0.481 . . . . 4.7999999999999998 109.998 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 89.4 m -70.37 -34.24 72.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.873 -0.603 . . . . 4.4100000000000001 110.627 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 60.9 mt -70.0 -25.73 63.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.92 -0.582 . . . . 4.8499999999999996 110.454 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.93 25.48 45.07 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.955 -0.566 . . . . 3.6899999999999999 112.683 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 38.7 pt -102.42 146.65 10.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.848 0.356 . . . . 4.0099999999999998 110.146 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.63 -70.0 0.74 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 4.4299999999999997 112.102 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.602 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -160.18 14.39 0.13 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.357 0.503 . . . . 5.5599999999999996 112.357 -179.272 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -89.26 56.66 3.73 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 121.992 -0.442 . . . . 4.4699999999999998 111.382 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -159.25 170.11 22.62 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.395 -0.366 . . . . 3.96 110.869 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.02 132.86 29.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.118 -0.492 . . . . 1.98 110.95 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 1.5 pp -99.87 165.06 11.75 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.321 -0.4 . . . . 2.3999999999999999 110.456 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -121.84 126.34 48.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.321 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 47.6 mt -100.13 115.14 40.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 2.5 111.162 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.405 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 41.5 m-85 -102.9 105.93 16.39 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.404 -0.591 . . . . 4.3899999999999997 109.404 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 t -85.37 106.52 15.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.926 0.393 . . . . 3.6000000000000001 111.1 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.6 84.01 2.03 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.049 -0.523 . . . . 4.7400000000000002 110.348 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 62.34 -99.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.426 -0.806 . . . . 5.3799999999999999 111.302 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.97 1.95 24.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.05 0.453 . . . . 3.7599999999999998 110.655 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -109.74 102.87 11.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.893 -0.594 . . . . 4.3499999999999996 110.546 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 45.3 mt -91.44 95.22 5.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.305 -0.628 . . . . 2.4199999999999999 109.305 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' B' ' 37' ' ' TYR . 27.1 mt -81.14 122.87 36.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.908 -0.587 . . . . 2.6899999999999999 111.014 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 2.5 mp -115.4 113.06 23.26 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 2.3599999999999999 110.938 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -95.62 130.14 42.59 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.771 -0.826 . . . . 3.21 108.771 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -54.28 -61.17 2.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.868 0.73 . . . . 3.6600000000000001 111.559 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -168.68 163.53 12.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.896 0.379 . . . . 5.2000000000000002 110.769 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 133.23 5.23 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 108.554 -0.906 . . . . 5.0999999999999996 108.554 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.38 -66.05 0.1 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.358 2.038 . . . . 3.8100000000000001 112.072 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 61.8 t30 59.09 105.97 0.02 OUTLIER 'General case' 0 C--O 1.234 0.269 0 O-C-N 123.77 0.669 . . . . 5.2000000000000002 111.23 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.67 81.8 1.13 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.039 -0.528 . . . . 6.1900000000000004 110.254 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.13 145.99 25.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.205 -0.452 . . . . 5.4199999999999999 111.375 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -71.23 115.03 9.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.697 -0.683 . . . . 5.5199999999999996 109.594 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.506 -0.315 . . . . 6.3799999999999999 110.554 -179.872 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.435 ' H3 ' ' HG2' ' C' ' 21' ' ' GLU . 1.1 mtt . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.723 0.297 . . . . 7.7999999999999998 110.37 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -161.1 74.34 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.03 -0.532 . . . . 8.5700000000000003 111.143 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -86.15 45.89 1.27 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.345 0.593 . . . . 5.0099999999999998 110.177 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.2 m -117.32 81.62 1.68 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.848 -0.615 . . . . 4.25 111.325 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.11 79.57 0.58 Allowed Glycine 0 N--CA 1.449 -0.459 0 CA-C-N 115.852 -0.613 . . . . 2.4700000000000002 112.79 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -104.73 111.37 34.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.882 0.372 . . . . 3.96 110.514 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.2 t -95.98 103.53 14.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.884 -0.598 . . . . 2.5299999999999998 109.691 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -150.84 157.49 42.99 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.068 -0.515 . . . . 3.6000000000000001 110.542 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' D' ' 32' ' ' ASP . 25.5 ttpt -60.38 122.45 14.59 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.62 -0.511 . . . . 2.6400000000000001 109.62 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.557 HG23 ' H ' ' C' ' 11' ' ' ASP . 0.7 OUTLIER -52.5 -66.22 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 112.478 0.547 . . . . 2.7000000000000002 112.478 -178.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' D' ' 30' ' ' GLU . 2.0 t70 177.33 141.98 0.08 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.273 -1.01 . . . . 3.5699999999999998 108.273 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -80.84 47.22 0.96 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.266 0.555 . . . . 3.21 111.179 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.49 HD22 ' HA ' ' C' ' 13' ' ' LEU . 0.3 OUTLIER -160.5 -61.32 0.06 Allowed 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.362 -0.835 . . . . 3.3900000000000001 110.064 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.26 3.97 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.306 -0.95 . . . . 3.1600000000000001 113.57 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.569 ' NE ' HG22 ' D' ' 17' ' ' VAL . 9.2 mpt_? -88.39 171.63 9.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 117.194 0.497 . . . . 5.0499999999999998 111.016 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.411 ' H ' HG13 ' D' ' 16' ' ' VAL . 96.4 t -124.64 135.65 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.024 -0.535 . . . . 2.6400000000000001 110.906 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' C' ' 10' ' ' VAL . 3.0 m -84.52 57.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-N 116.011 -0.541 . . . . 3.4399999999999999 111.885 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.408 HG23 ' NE ' ' C' ' 23' ' ' ARG . 2.5 tt -76.62 127.27 84.69 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 109.329 -0.619 . . . . 3.3399999999999999 109.329 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -33.91 125.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 124.349 3.366 . . . . 2.6600000000000001 114.272 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.8 tt -63.93 -39.54 85.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.765 -0.652 . . . . 4.46 111.599 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . 0.435 ' HG2' ' H3 ' ' C' ' 1' ' ' MET . 1.2 pp20? -65.21 -30.57 71.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 4.1799999999999997 110.648 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.428 HD21 ' HB ' ' D' ' 38' ' ' VAL . 34.5 tp -66.06 -51.73 55.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.205 -0.452 . . . . 3.5299999999999998 110.229 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.489 HH22 " C3'" ' F' ' 5' ' ' ' DT' . 39.3 mtm180 -68.68 -25.56 64.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.919 -0.582 . . . . 4.2199999999999998 110.954 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . 0.404 ' NH1' ' HB2' ' C' ' 21' ' ' GLU . 13.2 ttp180 -65.88 -32.94 74.74 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.982 -0.747 . . . . 5.04 108.982 177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.5 m -87.11 -31.98 20.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.301 -0.863 . . . . 4.29 110.954 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 85.1 mt -72.45 -82.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 5.0199999999999996 110.764 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 61.3 58.83 11.52 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.829 -0.701 . . . . 4.0800000000000001 112.411 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . 0.443 HD13 ' HG2' ' D' ' 41' ' ' GLU . 2.1 pt -115.44 -50.39 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 111.829 0.307 . . . . 4.4699999999999998 111.829 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -170.5 18.55 0.02 OUTLIER 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.09 0.404 . . . . 3.6899999999999999 112.09 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.44 ' O ' HG11 ' D' ' 10' ' ' VAL . 1.5 mp0 -67.46 -12.43 60.27 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.729 0.3 . . . . 5.5800000000000001 111.325 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.58 12.27 26.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.525 -0.307 . . . . 5.1399999999999997 110.822 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -121.75 -79.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.603 -0.271 . . . . 2.8199999999999998 111.351 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -152.98 144.85 23.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.712 -0.477 . . . . 2.2599999999999998 109.712 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.518 HD23 HG22 ' D' ' 10' ' ' VAL . 2.6 pp -119.03 151.08 38.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.896 0.379 . . . . 2.6600000000000001 111.192 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.46 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 34.3 tt0 -99.81 118.61 36.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.971 -0.558 . . . . 2.25 110.395 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' D' ' 8' ' ' ARG . 1.2 mt -84.75 116.75 28.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.922 -0.581 . . . . 2.2400000000000002 110.779 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.44 170.87 12.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 2.3999999999999999 110.382 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.52 140.43 44.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.813 -0.44 . . . . 2.5499999999999998 109.813 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . 0.441 ' CB ' HD13 ' C' ' 44' ' ' ILE . 3.0 t70 -134.54 91.29 2.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.716 0.293 . . . . 2.29 111.274 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t70 68.04 -74.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.422 -0.808 . . . . 3.0 111.857 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -132.75 -32.68 1.25 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.255 -0.43 . . . . 3.1400000000000001 110.424 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.39 171.71 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.057 -0.519 . . . . 2.96 110.288 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 28.9 mm -106.9 141.65 21.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.1 -0.5 . . . . 2.3199999999999998 109.863 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . 0.441 HD13 ' CB ' ' C' ' 39' ' ' ASP . 1.2 mp -120.5 134.85 62.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.893 0.378 . . . . 2.27 110.794 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.503 ' HB2' ' HB ' ' D' ' 43' ' ' ILE . 10.7 mt -112.76 117.3 31.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.97 -0.752 . . . . 2.4399999999999999 108.97 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -109.42 -170.34 1.64 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.251 -0.432 . . . . 3.02 111.003 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 32.7 mtmt -76.27 -78.43 0.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.98 -0.555 . . . . 2.96 110.637 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 41.4 p90 178.53 147.93 0.18 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 110.726 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -103.29 123.5 41.48 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 109.398 -0.594 . . . . 3.2400000000000002 109.398 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.93 111.81 1.17 Allowed 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.435 2.09 . . . . 3.5 111.403 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -146.9 150.25 34.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.041 0.448 . . . . 3.7200000000000002 111.111 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.74 -21.2 3.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.617 -0.719 . . . . 6.0099999999999998 110.26 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 131.4 34.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.858 -0.61 . . . . 5.6200000000000001 110.96 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 2.4 p -69.84 -24.92 63.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.208 0.528 . . . . 4.1200000000000001 110.491 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.821 -0.627 . . . . 5.3099999999999996 110.587 179.43 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.745 0.307 . . . . 3.6899999999999999 110.503 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -145.47 175.72 10.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.094 -0.503 . . . . 3.5699999999999998 110.292 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.0 20.04 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.156 -0.475 . . . . 2.6400000000000001 111.579 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.61 21.1 2.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.185 -0.461 . . . . 2.4399999999999999 110.92 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.76 51.74 3.16 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.799 -0.92 . . . . 1.9199999999999999 110.799 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mt -122.54 144.54 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.769 0.319 . . . . 2.4500000000000002 111.034 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.46 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 9.9 m -85.48 147.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 112.431 0.53 . . . . 2.6099999999999999 112.431 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.58 ' HB2' HD11 ' C' ' 36' ' ' ILE . 2.1 tmt_? -137.18 145.88 44.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.633 -0.712 . . . . 2.77 109.101 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -65.15 137.33 57.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.1 0.476 . . . . 3.1499999999999999 111.952 -178.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.518 HG22 HD23 ' C' ' 34' ' ' LEU . 25.0 t -81.89 -76.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.719 -0.845 . . . . 3.0800000000000001 108.719 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.2 -166.92 0.1 Allowed 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.854 -0.795 . . . . 4.5899999999999999 108.854 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 -43.1 7.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.801 0.334 . . . . 6.0599999999999996 110.764 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.8 -61.15 2.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 4.8399999999999999 111.135 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.49 55.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.804 -0.712 . . . . 3.4300000000000002 112.203 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -119.57 115.34 23.8 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.11 -0.7 . . . . 4.5099999999999998 109.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' C' ' 15' ' ' ARG . 1.5 p -69.88 96.53 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.31 0.576 . . . . 2.75 111.263 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.569 HG22 ' NE ' ' C' ' 15' ' ' ARG . 3.6 t -97.38 109.93 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.51 -0.768 . . . . 3.3599999999999999 109.497 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 23.5 pt -92.25 152.8 42.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 CA-C-N 116.295 -0.411 . . . . 3.0800000000000001 109.963 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.39 117.37 4.1 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.339 2.026 . . . . 3.46 111.977 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' D' ' 23' ' ' ARG . 2.8 pp -65.94 -21.19 28.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.501 0.667 . . . . 4.8200000000000003 110.02 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' D' ' 24' ' ' ARG . 1.8 mp0 -63.4 -25.82 68.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.235 -0.893 . . . . 4.9800000000000004 109.904 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 39.7 tp -70.35 -40.0 74.35 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.42 -0.585 . . . . 3.25 109.42 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' D' ' 20' ' ' ILE . 13.9 ptt180 -64.4 -28.25 69.56 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 109.282 -0.636 . . . . 2.8799999999999999 109.282 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' D' ' 21' ' ' GLU . 22.6 mtt180 -67.27 -49.62 63.6 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.498 -0.773 . . . . 6.0999999999999996 110.019 178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 4.7 m -62.78 -41.75 99.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.671 -0.695 . . . . 3.73 110.874 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.8 -46.34 68.93 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 2.9700000000000002 110.877 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.69 36.12 2.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.577 -0.82 . . . . 2.79 111.656 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.09 175.58 8.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 110.141 -0.318 . . . . 2.1499999999999999 110.141 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.0 -177.15 3.59 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.745 0.307 . . . . 2.46 110.3 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.663 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 1.4 pm0 -78.94 -12.78 60.04 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.28 0.562 . . . . 3.3999999999999999 110.319 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -96.52 27.11 3.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.843 -0.617 . . . . 3.4399999999999999 110.281 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' C' ' 9' ' ' LYS . 0.6 OUTLIER -100.89 142.12 32.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.047 -0.524 . . . . 2.6600000000000001 111.025 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.08 107.28 19.11 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.165 -0.47 . . . . 2.2999999999999998 110.427 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 85.0 mt -100.67 157.89 16.35 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.204 -0.453 . . . . 2.1099999999999999 110.455 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 72.3 tt0 -99.97 107.88 19.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.13 0.491 . . . . 2.3399999999999999 110.355 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 3.7 mp -89.76 118.94 36.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.897 -0.592 . . . . 2.3300000000000001 110.538 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . 0.471 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 25.0 t80 -125.19 166.47 16.41 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.057 -0.72 . . . . 2.2400000000000002 109.057 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . 0.428 ' HB ' HD21 ' C' ' 22' ' ' LEU . 7.7 p -125.14 137.43 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.05 0.452 . . . . 2.1400000000000001 111.042 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 18.0 t70 -130.79 103.7 6.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.806 -0.634 . . . . 1.99 110.281 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.99 -81.1 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.747 0.655 . . . . 2.7599999999999998 111.296 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . 0.443 ' HG2' HD13 ' C' ' 28' ' ' ILE . 12.1 tt0 -146.8 20.64 1.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 2.3500000000000001 110.919 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 54.1 pttt -123.02 152.62 40.76 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.214 -0.291 . . . . 2.3399999999999999 110.214 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 31.1 mt -88.59 127.42 41.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.854 0.359 . . . . 1.99 110.994 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . 0.471 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 22.6 mm -99.32 115.77 40.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.891 -0.595 . . . . 2.0 109.828 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HB ' ' C' ' 43' ' ' ILE . 10.7 tp -105.75 94.6 5.28 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 2.77 110.181 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 29.2 mtpt -92.28 159.67 15.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.841 -0.618 . . . . 2.3599999999999999 110.746 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' D' ' 48' ' ' TYR . 9.5 pttp -127.57 -72.13 0.64 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.209 -0.45 . . . . 2.9900000000000002 110.776 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.452 ' H ' ' HG3' ' D' ' 47' ' ' LYS . 52.0 p90 -166.86 171.45 11.3 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.503 -0.554 . . . . 3.2599999999999998 109.503 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -79.16 129.94 71.02 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.131 -0.322 . . . . 5.0300000000000002 110.131 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.54 -107.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.624 2.216 . . . . 3.73 111.946 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 52.69 33.38 13.73 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.285 0.565 . . . . 4.6200000000000001 110.187 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.6 tpt -144.97 142.31 29.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.597 -0.729 . . . . 5.29 110.25 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.89 165.48 24.93 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.245 -0.434 . . . . 5.8300000000000001 110.718 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.29 127.34 31.35 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.343 -0.614 . . . . 4.5199999999999996 109.343 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.401 -0.809 . . . . 7.0 110.152 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.704 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.489 0 O4'-C1'-C2' 107.215 1.014 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.704 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 N19-C1'-C2' 117.255 1.91 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.75 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O3'-P-O5' 101.26 -1.442 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.75 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-N19 109.76 2.45 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.621 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.413 2.017 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.646 " H1'" ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.19 1.738 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.693 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 109.283 1.854 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.693 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.756 0 O4'-C1'-N19 109.66 2.325 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.739 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O3'-P-O5' 100.369 -1.911 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.739 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-N19 109.421 2.027 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.486 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-N19 109.565 2.206 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.492 " C2'" ' H72' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.898 2.622 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.609 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.621 0 O4'-C1'-N19 109.646 2.308 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.609 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-N19 109.437 2.046 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.584 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 O4'-C1'-N19 109.847 2.559 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.584 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O3'-P-O5' 99.598 -2.317 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.473 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O4'-C1'-N19 109.735 2.419 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.63 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.714 0 O3'-P-O5' 99.513 -2.362 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.63 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-N19 109.425 2.032 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.673 0 O4'-C1'-N19 109.634 2.292 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.458 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.796 0 O4'-C1'-N19 109.361 1.951 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.466 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-N19 109.594 2.242 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.638 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.465 0 O4'-C1'-N19 109.69 2.362 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.638 ' H71' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.607 0 O3'-P-O5' 100.382 -1.904 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.622 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.529 0.567 0 N19-C1'-C2' 115.931 1.082 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.72 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O5'-C5'-C4' 111.585 0.99 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.72 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.869 0 N19-C1'-C2' 116.786 1.616 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.607 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 O4'-C1'-N19 109.762 2.453 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.417 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.955 2.694 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.593 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O3'-P-O5' 99.694 -2.266 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.593 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-N19 109.557 2.197 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.547 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.837 0 O4'-C1'-N19 109.603 2.254 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.551 H2'' ' C5 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.87 0 O3'-P-O5' 99.566 -2.334 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.551 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.86 0 O4'-C1'-N19 110.186 2.983 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.527 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O3'-P-O5' 99.499 -2.369 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.527 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-N19 109.427 2.033 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.728 " H1'" ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.774 0 N19-C1'-C2' 118.103 2.439 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.728 ' C8 ' " H1'" ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 O4'-C1'-N19 109.871 2.588 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.457 " C2'" ' H72' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.708 0 O3'-P-O5' 99.224 -2.514 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.473 " C2'" ' H72' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 O4'-C1'-N19 109.819 2.524 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.733 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.772 0 O3'-P-O5' 99.788 -2.217 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.733 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.835 0 O4'-C1'-N19 110.052 2.815 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.621 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.823 0 O3'-P-O5' 100.189 -2.006 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.621 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.795 0 O4'-C1'-N19 110.077 2.847 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.647 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.872 0 O3'-P-O5' 100.084 -2.061 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.647 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.072 0 O4'-C1'-N19 109.8 2.5 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.757 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.6 -0.597 0 O3'-P-O5' 100.224 -1.987 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.757 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 N19-C1'-C2' 116.997 1.748 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.656 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.781 1.227 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.584 ' H71' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 N19-C1'-C2' 115.973 1.108 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.567 ' N ' ' HB3' ' D' ' 21' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 110.114 -0.328 . . . . 9.4199999999999999 110.114 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HE2' ' OG1' ' D' ' 25' ' ' THR . 0.0 OUTLIER -105.54 147.7 28.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 10.67 111.339 -179.533 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.423 ' CB ' ' HB ' ' B' ' 38' ' ' VAL . 0.0 OUTLIER -78.92 -2.65 40.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.606 -0.724 . . . . 7.75 111.72 -179.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.49 -7.19 41.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.262 -0.426 . . . . 5.6600000000000001 112.01 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 122.55 88.62 0.92 Allowed Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.697 -0.763 . . . . 3.5699999999999998 112.291 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 tp -102.9 125.69 57.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 120.959 0.409 . . . . 4.6799999999999997 110.425 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.9 t -80.34 112.25 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.113 -0.494 . . . . 3.27 110.183 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -112.71 134.25 54.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.247 -0.433 . . . . 4.4500000000000002 110.519 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 126.76 30.47 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.825 -0.625 . . . . 2.8900000000000001 110.985 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.6 t -84.75 109.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 108.413 -0.958 . . . . 2.9399999999999999 108.413 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -75.99 -169.52 1.14 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.085 -0.507 . . . . 4.4400000000000004 111.606 -178.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.98 36.73 0.06 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.949 -0.569 . . . . 3.6099999999999999 111.936 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.447 HD21 ' N7 ' ' F' ' 17' ' ' ' DG' . 2.3 mm? -121.55 -33.03 3.7 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.287 -0.415 . . . . 4.3499999999999996 110.667 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.83 29.31 72.61 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.379 -0.915 . . . . 2.0899999999999999 110.897 -178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' B' ' 16' ' ' VAL . 0.1 OUTLIER -119.57 158.86 25.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.686 0.279 . . . . 3.6099999999999999 110.397 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 11.4 t -94.76 113.88 30.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.077 -0.511 . . . . 2.3300000000000001 110.776 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -90.45 106.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 2.4100000000000001 110.093 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 2.6 tp -81.68 127.29 73.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.145 -0.48 . . . . 3.1499999999999999 111.077 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 39.7 Cg_exo -62.61 163.91 19.89 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.764 2.309 . . . . 2.71 112.608 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.0 mt -64.82 -47.52 88.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 3.73 111.238 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -58.34 -52.35 65.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 4.3099999999999996 110.698 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 16.5 mt -62.88 -40.73 98.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.581 -0.736 . . . . 3.5800000000000001 111.648 -178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -62.57 -38.07 88.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.706 0.288 . . . . 2.9500000000000002 110.974 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.98 -25.82 60.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.762 0.315 . . . . 3.8700000000000001 110.83 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.2 m -86.37 -14.18 44.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.999 0.428 . . . . 4.0899999999999999 110.832 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 27.8 mt -61.08 -35.07 76.01 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.962 -0.563 . . . . 4.4900000000000002 111.206 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.47 31.28 54.89 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.844 -0.693 . . . . 3.7400000000000002 112.994 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 pt -128.54 179.39 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.749 0.309 . . . . 4.1100000000000003 110.834 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.19 -175.44 5.73 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.84 -0.618 . . . . 4.9900000000000002 111.45 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.6 -57.08 7.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.761 -0.654 . . . . 6.1699999999999999 111.053 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.572 ' HA ' HG11 ' B' ' 10' ' ' VAL . 83.3 mttt -112.19 85.96 2.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 4.1200000000000001 111.341 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -109.9 -178.84 3.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.681 -0.69 . . . . 3.98 110.278 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -110.57 145.56 37.6 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.892 -0.41 . . . . 2.9500000000000002 109.892 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -131.29 148.44 52.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 2.9500000000000002 111.095 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 7' ' ' VAL . 18.0 mt-10 -97.51 107.82 20.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.816 -0.629 . . . . 3.5099999999999998 109.655 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.3 mt -87.98 110.13 20.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.914 -0.585 . . . . 2.75 111.449 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.535 ' CE2' ' HB2' ' A' ' 39' ' ' ASP . 93.2 t80 -108.77 102.55 11.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.007 -0.542 . . . . 6.1299999999999999 109.839 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.8 t -85.47 115.13 26.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.452 -0.34 . . . . 3.1800000000000002 110.216 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.535 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 19.5 t0 -122.94 95.05 4.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.221 -0.445 . . . . 3.6800000000000002 111.111 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.28 -93.51 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.549 -0.751 . . . . 4.2800000000000002 111.619 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -122.33 13.32 10.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 3.1699999999999999 111.054 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 9.4 ptpp? -124.9 142.61 51.34 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.088 -0.338 . . . . 2.9100000000000001 110.088 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 73.4 mt -116.12 108.24 24.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.396 -0.366 . . . . 2.2599999999999998 110.385 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 73.3 mt -92.87 113.28 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.067 -0.515 . . . . 3.1000000000000001 110.014 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 18.2 mt -98.07 99.46 10.73 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.876 -0.602 . . . . 2.4399999999999999 110.264 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 75.4 mttt -84.7 113.32 21.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.2 -0.667 . . . . 5.3899999999999997 109.2 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' HB3' ' A' ' 26' ' ' LEU . 5.1 ptmm? -117.82 174.21 6.31 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.781 -0.645 . . . . 4.1399999999999997 111.056 -178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -88.56 -176.34 5.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.848 -0.615 . . . . 5.4199999999999999 109.976 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -161.8 63.56 1.61 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.878 0.371 . . . . 4.54 110.697 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.65 -22.16 70.1 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.355 2.036 . . . . 5.0199999999999996 112.602 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -75.81 -22.83 55.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.262 -0.426 . . . . 6.6799999999999997 111.004 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 17.8 ttt -73.0 -41.59 64.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.067 0.46 . . . . 6.4699999999999998 110.33 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -92.51 38.85 1.02 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.929 -0.578 . . . . 5.7699999999999996 111.24 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.66 86.91 7.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.299 -0.41 . . . . 4.5499999999999998 110.168 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.218 -0.446 . . . . 6.7999999999999998 111.121 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 C--O 1.233 0.198 0 CA-C-O 121.076 0.465 . . . . 10.279999999999999 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.503 ' HA ' HD21 ' B' ' 22' ' ' LEU . 14.7 mptt -67.11 136.16 54.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.894 -0.594 . . . . 9.0299999999999994 110.743 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . 0.527 ' H ' HD11 ' B' ' 22' ' ' LEU . 0.8 OUTLIER -75.83 92.52 3.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.18 -0.464 . . . . 6.5800000000000001 110.514 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.4 79.95 6.2 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.199 -0.455 . . . . 5.3399999999999999 111.829 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.35 54.43 1.02 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.771 -0.728 . . . . 4.1100000000000003 111.99 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.6 tp -96.49 130.57 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.928 0.394 . . . . 4.25 110.632 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.611 HG22 ' HG2' ' A' ' 35' ' ' GLU . 11.2 t -83.88 121.74 36.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.436 -0.347 . . . . 3.3199999999999998 110.153 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' B' ' 8' ' ' ARG . 20.9 mtt180 -132.1 141.82 49.3 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.342 -0.39 . . . . 4.4699999999999998 109.967 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.31 158.4 35.18 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.168 -0.678 . . . . 3.3999999999999999 109.168 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 31' ' ' LYS . 7.7 p -51.1 154.1 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 123.52 0.512 . . . . 3.48 112.093 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.54 -38.09 89.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 4.5199999999999996 110.082 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 179.12 -69.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.314 -0.857 . . . . 4.8899999999999997 109.474 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.464 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.8 mm? -124.27 -96.28 0.45 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.178 -0.465 . . . . 3.8199999999999998 110.251 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.04 55.71 0.96 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.755 -0.736 . . . . 2.7000000000000002 112.103 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -145.19 138.49 26.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.585 0.231 . . . . 3.7799999999999998 110.393 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 3.0 t -105.24 140.61 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.717 -0.475 . . . . 3.0 109.717 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.528 HG12 ' H ' ' B' ' 18' ' ' ILE . 0.4 OUTLIER -88.0 172.4 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.261 0.553 . . . . 2.9100000000000001 112.478 -178.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.528 ' H ' HG12 ' B' ' 17' ' ' VAL . 12.8 tt -144.93 139.08 14.85 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 115.07 -0.968 . . . . 2.4399999999999999 108.455 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.457 ' HD2' HG13 ' B' ' 18' ' ' ILE . 88.4 Cg_exo -47.31 119.36 3.51 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.094 2.529 . . . . 2.5699999999999998 113.97 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.524 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 13.0 tt -64.53 -39.0 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.082 0 CA-C-N 115.462 -0.79 . . . . 4.2800000000000002 111.535 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -60.22 -39.43 86.64 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.274 -0.421 . . . . 4.7400000000000002 111.427 -178.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.527 HD11 ' H ' ' B' ' 3' ' ' SER . 30.1 mt -72.72 -42.77 63.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.161 -0.472 . . . . 3.6499999999999999 110.701 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -31.08 68.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.853 -0.339 . . . . 3.98 111.364 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -67.25 -28.52 68.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.94 0.4 . . . . 4.7999999999999998 110.121 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -95.65 -6.36 40.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.55 0.69 . . . . 4.4100000000000001 109.633 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' B' ' 22' ' ' LEU . 12.5 tp -102.05 81.87 2.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.129 -0.942 . . . . 4.8499999999999996 109.907 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.65 47.34 2.73 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.834 -0.621 . . . . 3.6899999999999999 113.505 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 pt -101.74 166.84 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 110.035 -0.357 . . . . 4.0099999999999998 110.035 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.29 141.32 58.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.006 0.431 . . . . 4.4299999999999997 111.635 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.7 -33.53 14.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 5.5599999999999996 109.641 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -73.64 75.85 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.786 -0.643 . . . . 4.4699999999999998 110.068 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -129.62 -153.72 0.59 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.985 -0.552 . . . . 3.96 110.042 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.23 126.66 13.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.638 0.256 . . . . 1.98 110.329 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.415 HD13 HD23 ' B' ' 45' ' ' LEU . 96.4 mt -117.43 147.86 42.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.343 -0.389 . . . . 2.3999999999999999 110.335 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.66 121.59 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.186 -0.461 . . . . 3.0 110.462 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.1 mt -95.68 99.06 8.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.92 -0.582 . . . . 2.5 110.635 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -107.5 115.74 30.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.929 -0.578 . . . . 4.3899999999999997 109.845 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.423 ' HB ' ' CB ' ' A' ' 3' ' ' SER . 39.1 t -92.52 107.93 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.678 -0.49 . . . . 3.6000000000000001 109.678 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -87.44 96.31 10.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.982 -0.554 . . . . 4.7400000000000002 110.728 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 71.63 -70.71 0.15 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 124.115 0.885 . . . . 5.3799999999999999 111.274 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.03 -30.95 0.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.478 -0.328 . . . . 3.7599999999999998 111.274 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -83.45 164.63 19.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.906 -0.405 . . . . 4.3499999999999996 109.906 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.402 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 12.3 mt -113.41 136.83 48.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 C-N-CA 120.585 -0.446 . . . . 2.4199999999999999 111.688 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 67.6 mt -126.57 114.32 37.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 N-CA-C 109.381 -0.6 . . . . 2.6899999999999999 109.381 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.415 HD23 HD13 ' B' ' 34' ' ' LEU . 1.9 mp -94.89 125.27 39.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.835 0.35 . . . . 2.3599999999999999 110.962 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm -116.91 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 3.21 109.826 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -87.05 -168.86 2.39 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.612 0.244 . . . . 3.6600000000000001 110.619 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -60.07 146.67 42.07 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.0 0.429 . . . . 5.2000000000000002 111.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.478 ' HB2' ' HD2' ' B' ' 50' ' ' PRO . 59.3 pttt -134.0 165.42 36.86 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.923 -0.58 . . . . 5.0999999999999996 109.944 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' B' ' 49' ' ' LYS . 99.5 Cg_exo -45.03 -57.72 1.94 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 123.108 2.539 . . . . 3.8100000000000001 113.259 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -77.51 98.86 5.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 5.2000000000000002 110.146 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.51 174.56 7.21 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.969 -0.559 . . . . 6.1900000000000004 111.219 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.84 139.11 58.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 5.4199999999999999 111.241 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 11.1 t -88.03 131.46 34.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.181 -0.463 . . . . 5.5199999999999996 110.276 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.326 -0.397 . . . . 6.3799999999999999 110.863 -179.867 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 80.4 mtp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.154 0.502 . . . . 7.7999999999999998 110.679 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -113.7 23.74 12.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.873 -0.603 . . . . 8.5700000000000003 109.969 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.17 -14.35 60.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.59 -0.732 . . . . 5.0099999999999998 111.563 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -10.78 60.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.216 0.531 . . . . 4.25 111.043 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 173.6 82.3 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.83 0 N-CA-C 111.153 -0.779 . . . . 2.4700000000000002 111.153 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . 0.426 ' H ' HG13 ' C' ' 6' ' ' ILE . 6.2 mt -72.49 91.78 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.029 0.443 . . . . 3.96 110.11 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 0.5 OUTLIER -73.38 89.65 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.695 -0.684 . . . . 2.5299999999999998 110.632 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.78 129.12 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.604 -0.726 . . . . 3.6000000000000001 110.356 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.07 148.87 47.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.555 -0.748 . . . . 2.6400000000000001 111.058 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.419 HG22 HG22 ' C' ' 16' ' ' VAL . 5.2 t -86.14 132.32 32.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 108.946 -0.761 . . . . 2.7000000000000002 108.946 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -69.82 165.67 21.0 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.812 -0.44 . . . . 3.5699999999999998 109.812 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -12.17 60.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.061 0.458 . . . . 3.21 110.291 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.591 HD21 ' N4 ' ' F' ' 8' ' ' ' DC' . 0.5 OUTLIER -87.17 4.74 41.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.706 -0.679 . . . . 3.3900000000000001 109.973 179.339 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . 0.438 ' HA3' ' NH1' ' D' ' 23' ' ' ARG . . . 69.86 34.87 72.04 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.001 -0.84 . . . . 3.1600000000000001 111.001 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.66 ' HG3' ' O ' ' D' ' 16' ' ' VAL . 5.4 ttp85 -126.99 132.63 50.74 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.669 -0.493 . . . . 5.0499999999999998 109.669 -178.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.482 HG21 HD12 ' D' ' 34' ' ' LEU . 41.3 t -89.5 127.53 42.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.891 -0.323 . . . . 2.6400000000000001 110.638 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 4.1 t -69.37 88.06 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.961 -0.563 . . . . 3.4399999999999999 110.251 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.44 HG13 ' HD2' ' C' ' 19' ' ' PRO . 2.3 tp -58.36 139.52 84.56 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 109.898 -0.408 . . . . 3.3399999999999999 109.898 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG13 ' C' ' 18' ' ' ILE . 32.5 Cg_exo -62.92 99.73 0.23 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.3 2.0 . . . . 2.6600000000000001 112.108 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.6 -10.73 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.733 -0.469 . . . . 4.46 109.733 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.59 -29.94 62.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 4.1799999999999997 110.434 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.96 -31.8 71.78 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.336 -0.616 . . . . 3.5299999999999998 109.336 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.461 ' HA ' ' HA3' ' C' ' 27' ' ' GLY . 68.9 mtm-85 -88.16 -20.28 25.82 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.517 -0.549 . . . . 4.2199999999999998 109.517 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . 0.495 HH21 " H3'" ' F' ' 4' ' ' ' DG' . 38.5 ttm180 -70.44 -48.33 56.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.02 -0.991 . . . . 5.04 109.638 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.19 -45.71 12.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.651 -0.704 . . . . 4.29 110.196 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 76.5 mt -113.54 -108.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.38 . . . . 5.0199999999999996 110.616 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' C' ' 23' ' ' ARG . . . 67.04 -177.42 19.58 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.294 -0.479 . . . . 4.0800000000000001 113.037 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . 0.474 ' HB ' ' OD2' ' C' ' 32' ' ' ASP . 3.4 mt -139.66 -73.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.153 -0.684 . . . . 4.4699999999999998 109.153 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.88 158.76 37.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.779 -0.646 . . . . 3.6899999999999999 110.126 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -86.92 6.91 29.66 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.951 0.405 . . . . 5.5800000000000001 111.113 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . 0.575 ' NZ ' ' HA ' ' D' ' 11' ' ' ASP . 6.4 tppt? -129.7 33.94 4.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.708 0.766 . . . . 5.1399999999999997 109.601 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . 0.474 ' OD2' ' HB ' ' C' ' 28' ' ' ILE . 59.0 m-20 -81.19 -178.31 6.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.277 -0.874 . . . . 2.8199999999999998 110.382 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -134.32 141.08 46.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.223 -0.444 . . . . 2.2599999999999998 110.394 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 52.1 mt -111.28 131.62 55.01 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 2.6600000000000001 110.703 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.83 108.53 13.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.891 -0.595 . . . . 2.25 110.127 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 53.3 mt -85.02 114.88 25.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 CA-C-O 120.895 0.378 . . . . 2.2400000000000002 110.417 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' D' ' 3' ' ' SER . 42.5 t80 -141.13 159.26 42.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.017 -0.734 . . . . 2.3999999999999999 109.017 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 1.1 m -119.09 153.21 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.035 0.445 . . . . 2.5499999999999998 111.166 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -140.58 97.7 3.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.847 -0.615 . . . . 2.29 110.308 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.63 -80.75 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.224 -0.898 . . . . 3.0 112.551 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -134.74 4.58 3.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.791 0.329 . . . . 3.1400000000000001 111.386 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -123.82 154.5 39.5 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.869 0.366 . . . . 2.96 110.799 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 27.6 mt -99.52 138.06 25.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.06 -0.518 . . . . 2.3199999999999998 109.829 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.4 128.65 73.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.983 0.42 . . . . 2.27 110.439 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.436 HD23 HD13 ' C' ' 34' ' ' LEU . 3.5 mp -118.51 106.64 12.88 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.732 -0.667 . . . . 2.4399999999999999 109.861 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 mtmt -103.59 160.89 14.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.289 -0.414 . . . . 3.02 110.585 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' C' ' 47' ' ' LYS . 30.9 pttt -80.68 136.95 36.28 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.352 -0.61 . . . . 2.96 109.352 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -56.96 145.39 30.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.208 0.528 . . . . 4.2000000000000002 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.28 158.08 34.52 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.453 -0.794 . . . . 3.2400000000000002 109.099 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -53.07 119.41 6.06 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.518 2.145 . . . . 3.5 111.625 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -165.34 164.97 19.72 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.707 -0.479 . . . . 3.7200000000000002 109.707 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 51.0 ttm -102.07 -68.59 0.82 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.572 0.225 . . . . 6.0099999999999998 110.601 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 -71.33 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.694 0.283 . . . . 5.6200000000000001 111.286 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 25.1 m -136.51 -33.46 0.8 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.604 -0.271 . . . . 4.1200000000000001 111.094 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 121.08 0.467 . . . . 5.3099999999999996 111.66 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.055 0.455 . . . . 3.6899999999999999 111.162 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' D' ' 6' ' ' ILE . 18.2 mmmt -97.06 138.12 35.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.776 -0.453 . . . . 3.5699999999999998 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 1.3 m -79.33 37.09 0.32 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.199 -0.455 . . . . 2.6400000000000001 111.957 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.76 25.61 10.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.321 0.582 . . . . 2.4399999999999999 110.145 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.79 42.39 2.68 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.927 -0.654 . . . . 1.9199999999999999 111.562 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . 0.423 HD12 ' HB2' ' D' ' 2' ' ' LYS . 41.6 mt -113.25 128.35 70.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.845 0.355 . . . . 2.4500000000000002 110.102 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 17.2 m -85.87 157.57 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.422 0.63 . . . . 2.6099999999999999 112.626 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.65 133.02 24.86 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.733 -1.21 . . . . 2.77 107.733 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -73.82 150.99 40.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.051 0.453 . . . . 3.1499999999999999 112.009 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 m -96.48 128.35 47.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.464 -0.939 . . . . 3.0800000000000001 108.464 177.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.575 ' HA ' ' NZ ' ' C' ' 31' ' ' LYS . 62.4 m-20 -111.39 -146.38 0.41 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.022 0.378 . . . . 4.5899999999999999 112.022 -177.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' D' ' 12' ' ' GLU . 0.0 OUTLIER -16.6 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 O-C-N 124.938 1.399 . . . . 6.0599999999999996 113.695 -179.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.526 ' HB2' ' HG3' ' D' ' 15' ' ' ARG . 0.5 OUTLIER -106.15 -13.41 15.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.057 -0.72 . . . . 4.8399999999999999 109.057 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.14 18.74 57.12 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.477 -0.783 . . . . 3.4300000000000002 111.917 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.534 ' CB ' ' HG2' ' C' ' 15' ' ' ARG . 67.1 mtm180 -60.16 133.36 56.03 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.356 -0.238 . . . . 4.5099999999999998 110.356 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' C' ' 15' ' ' ARG . 11.4 p -74.84 141.03 16.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.492 0.663 . . . . 2.75 111.689 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 15.9 t -98.43 130.33 47.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.57 -0.741 . . . . 3.3599999999999999 112.2 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 pt -132.77 106.39 12.81 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 108.697 -0.853 . . . . 3.0800000000000001 108.697 177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.95 145.43 19.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.38 2.72 . . . . 3.46 113.835 -178.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 1.2 pt -51.74 -47.35 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.738 -0.665 . . . . 4.8200000000000003 111.498 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' N ' ' A' ' 1' ' ' MET . 74.7 mt-10 -60.58 -34.82 74.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.549 -0.751 . . . . 4.9800000000000004 111.225 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.77 -37.08 65.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.977 0.418 . . . . 3.25 109.973 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . 0.438 ' NH1' ' HA3' ' C' ' 14' ' ' GLY . 70.8 mtm-85 -61.59 -46.79 88.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 2.8799999999999999 109.794 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -24.44 67.62 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.893 -0.594 . . . . 6.0999999999999996 110.203 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . 0.459 ' OG1' ' HE2' ' A' ' 2' ' ' LYS . 63.4 m -74.36 -49.19 23.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.615 . . . . 3.73 110.466 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 73.9 mt -71.09 -22.44 62.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 2.9700000000000002 110.799 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.48 21.15 27.57 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.799 -0.637 . . . . 2.79 112.162 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . 0.401 HG22 ' HE1' ' D' ' 48' ' ' TYR . 46.6 pt -112.6 155.68 13.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.762 0.315 . . . . 2.1499999999999999 110.436 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.21 177.62 4.59 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.604 -0.517 . . . . 2.46 109.604 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.569 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 1.2 pm0 -83.76 18.23 2.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.61 . . . . 3.3999999999999999 110.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -133.14 27.8 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.829 -0.804 . . . . 3.4399999999999999 108.829 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.18 -169.54 1.5 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.348 -0.842 . . . . 2.6600000000000001 110.67 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.01 118.44 10.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 110.396 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.523 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 23.0 mt -89.07 136.17 33.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.947 0.403 . . . . 2.1099999999999999 111.348 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -79.96 94.57 5.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.641 -0.709 . . . . 2.3399999999999999 109.227 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -88.49 112.87 24.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 121.526 0.679 . . . . 2.3300000000000001 111.251 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . 0.452 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 41.7 t80 -112.04 171.49 7.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.948 -1.024 . . . . 2.2400000000000002 109.016 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -128.97 131.63 68.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.744 0.307 . . . . 2.1400000000000001 110.45 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.3 t70 -126.56 102.24 7.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 1.99 109.954 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 64.84 -94.1 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.575 -0.738 . . . . 2.7599999999999998 111.677 179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -124.46 8.62 8.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.569 -0.287 . . . . 2.3500000000000001 111.508 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 52.6 pttt -122.86 151.43 41.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.054 0.454 . . . . 2.3399999999999999 111.061 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 mt -89.09 139.15 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.767 -0.651 . . . . 1.99 109.787 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . 0.452 ' HB ' ' HB3' ' D' ' 37' ' ' TYR . 29.4 mm -113.21 111.8 37.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 120.962 0.41 . . . . 2.0 110.572 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -96.3 102.99 14.86 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.216 -0.447 . . . . 2.77 109.887 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 38.3 mtpt -102.02 141.87 34.19 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.265 -0.425 . . . . 2.3599999999999999 110.69 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.49 153.49 41.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.999 -0.546 . . . . 2.9900000000000002 109.882 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.418 ' O ' ' HD3' ' D' ' 50' ' ' PRO . 5.2 p90 -68.3 169.15 11.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.097 -0.501 . . . . 3.2599999999999998 110.984 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -102.16 105.09 40.75 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.177 -0.465 . . . . 5.0300000000000002 110.773 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' D' ' 48' ' ' TYR . 2.8 Cg_exo -75.06 -38.04 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.705 2.27 . . . . 3.73 111.998 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.32 39.46 18.83 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.516 -0.766 . . . . 4.6200000000000001 110.644 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . 0.439 ' HG3' ' H ' ' D' ' 54' ' ' CYS . 6.3 tpt -150.81 133.04 15.39 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.09 -0.504 . . . . 5.29 110.462 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.73 -13.38 59.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.487 0.551 . . . . 5.8300000000000001 112.487 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . 0.439 ' H ' ' HG3' ' D' ' 52' ' ' MET . 7.7 m -131.83 110.28 10.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.103 -0.239 . . . . 4.5199999999999996 111.373 -179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.429 -0.796 . . . . 7.0 111.873 178.394 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.705 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.589 0 O4'-C1'-C2' 107.113 0.921 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.705 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 N19-C1'-C2' 117.664 2.165 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.742 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O3'-P-O5' 100.984 -1.587 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.742 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.767 2.458 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.533 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.342 1.927 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.688 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O3'-P-O5' 100.678 -1.748 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.688 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 O4'-C1'-N19 109.807 2.508 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.517 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-N19 109.149 1.686 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.657 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.466 0 O3'-P-O5' 99.803 -2.209 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.657 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O3'-P-O5' 100.729 -1.721 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.582 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 109.554 2.192 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.54 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.71 0 O3'-P-O5' 99.62 -2.305 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.611 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O3'-P-O5' 99.667 -2.281 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.611 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.774 0 O4'-C1'-N19 109.707 2.384 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.514 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.682 0 O4'-C1'-N19 109.761 2.452 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.514 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O3'-P-O5' 99.615 -2.308 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.496 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.79 0 O4'-C1'-N19 109.504 2.131 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.628 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.107 0 O4'-C1'-N19 109.756 2.445 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.628 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.805 0 O4'-C1'-N19 109.38 1.975 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.565 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.203 1.754 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C1'-N19 109.604 2.255 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.504 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O4'-C1'-N19 109.687 2.359 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.527 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.845 0 O3'-P-O5' 99.816 -2.202 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.648 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.676 0 N19-C1'-C2' 116.828 1.642 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.648 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 116.448 1.405 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.708 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 104.877 -0.723 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.88 0 N19-C1'-C2' 117.184 1.865 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.649 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 O4'-C1'-N19 110.406 3.258 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.551 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.614 2.268 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.551 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 O4'-C1'-N19 109.777 2.471 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.499 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-N19 109.672 2.34 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.571 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.819 0 O3'-P-O5' 99.693 -2.267 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.591 ' N4 ' HD21 ' C' ' 13' ' ' LEU . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 O4'-C1'-N19 109.562 2.202 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.479 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.576 2.22 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.512 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 100.114 -2.045 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.512 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-N19 109.577 2.221 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.507 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O3'-P-O5' 99.599 -2.316 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.731 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.424 -0.573 0 O3'-P-O5' 99.861 -2.179 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.731 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 109.796 2.494 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.487 ' H72' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 99.487 -2.375 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.698 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O3'-P-O5' 99.822 -2.199 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.698 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.804 0 O4'-C1'-N19 109.624 2.28 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.479 " H1'" " H5'" ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 109.809 2.511 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.817 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.945 0 N19-C1'-C2' 118.415 2.635 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.817 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.555 2.194 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.698 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.893 0 O4'-C1'-N19 109.771 2.464 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.72 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 100.648 -1.764 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.72 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O3'-P-O5' 100.871 -1.647 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.699 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 O3'-P-O5' 101.291 -1.426 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.417 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 N19-C1'-C2' 116.219 1.262 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.888 0.375 . . . . 9.4199999999999999 110.769 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.58 126.93 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.565 -0.532 . . . . 10.67 109.565 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.41 ' HB3' HG13 ' A' ' 6' ' ' ILE . 69.3 m -89.41 149.99 22.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.299 0.571 . . . . 7.75 112.345 -178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.62 45.67 1.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.492 -0.777 . . . . 5.6600000000000001 111.471 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.542 ' HA2' ' H ' ' B' ' 38' ' ' VAL . . . 79.91 58.59 2.79 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.506 -0.854 . . . . 3.5699999999999998 111.614 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 3' ' ' SER . 1.3 pt -164.0 -163.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 122.909 0.484 . . . . 4.6799999999999997 109.696 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.446 ' CG1' ' HB1' ' B' ' 33' ' ' ALA . 96.9 t -65.7 131.42 31.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.036 0.446 . . . . 3.27 110.693 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 ttt-85 -117.45 124.88 49.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.188 -0.46 . . . . 4.4500000000000002 110.344 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -65.98 118.95 10.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.941 -0.392 . . . . 2.8900000000000001 109.941 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.558 HG21 HD12 ' B' ' 34' ' ' LEU . 58.8 t -102.86 132.39 49.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.22 -0.445 . . . . 2.9399999999999999 110.452 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -86.32 -169.83 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.832 -0.622 . . . . 4.4400000000000004 109.802 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -73.9 67.46 1.24 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.496 0.665 . . . . 3.6099999999999999 110.289 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.4 mt -109.82 -49.07 3.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.626 -0.715 . . . . 4.3499999999999996 112.058 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.07 20.62 54.95 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.351 -0.928 . . . . 2.0899999999999999 111.424 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.83 164.16 4.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.615 -0.883 . . . . 3.6099999999999999 108.615 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.77 -163.28 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 121.124 -0.23 . . . . 2.3300000000000001 111.096 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.454 HG21 ' OP2' ' F' ' 16' ' ' ' DT' . 11.3 m -139.71 165.73 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.525 -0.307 . . . . 2.4100000000000001 110.466 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.1 pt -93.34 153.49 41.49 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.405 -0.361 . . . . 3.1499999999999999 111.109 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.447 ' HB3' ' OE2' ' A' ' 21' ' ' GLU . 36.3 Cg_exo -62.35 114.02 2.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.158 2.572 . . . . 2.71 112.544 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.572 ' HB ' ' OP1' ' F' ' 15' ' ' ' DT' . 2.9 tp -68.49 -36.3 74.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.261 -0.427 . . . . 3.73 111.212 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 24.6 pm0 -56.16 -41.97 76.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.005 0.431 . . . . 4.3099999999999996 110.911 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.526 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 81.9 mt -77.56 -44.96 26.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.218 -0.446 . . . . 3.5800000000000001 110.275 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -55.73 -46.65 77.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.785 -0.643 . . . . 2.9500000000000002 112.429 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -69.59 -39.66 77.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.79 -0.186 . . . . 3.8700000000000001 111.237 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -69.75 -24.3 63.51 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 4.0899999999999999 110.92 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 ' HD3' ' A' ' 47' ' ' LYS . 68.5 mt -70.36 -25.6 63.35 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.345 -0.389 . . . . 4.4900000000000002 110.569 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.88 39.42 64.76 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.873 -0.603 . . . . 3.7400000000000002 111.925 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.9 pt -104.01 -172.17 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.49 0.186 . . . . 4.1100000000000003 110.543 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.73 -151.98 0.42 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.888 0.375 . . . . 4.9900000000000002 111.464 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE1' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.0 -71.04 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.138 -0.483 . . . . 6.1699999999999999 110.85 -179.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -75.74 139.93 42.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.691 -0.231 . . . . 4.1200000000000001 110.384 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -170.57 -172.88 1.3 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.258 -0.428 . . . . 3.98 110.472 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' HG23 ' B' ' 10' ' ' VAL . . . -143.28 141.39 31.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.421 -0.354 . . . . 2.9500000000000002 110.352 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.8 mt -126.33 172.23 10.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.617 0.246 . . . . 2.9500000000000002 110.67 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HG2' HG12 ' B' ' 7' ' ' VAL . 36.0 mt-10 -95.31 120.82 36.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.426 -0.352 . . . . 3.5099999999999998 110.634 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.493 ' O ' HG13 ' A' ' 36' ' ' ILE . 29.5 pt -109.4 120.31 60.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.258 0.551 . . . . 2.75 110.475 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.525 ' HA ' ' HA2' ' B' ' 5' ' ' GLY . 22.2 m-85 -106.99 109.67 21.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.523 -0.762 . . . . 6.1299999999999999 110.492 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.5 t -81.53 103.96 9.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.269 0.557 . . . . 3.1800000000000002 109.731 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 42' ' ' LYS . 36.0 t70 -108.71 106.43 16.46 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.963 -0.562 . . . . 3.6800000000000002 110.306 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 66.69 -79.68 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.812 0.695 . . . . 4.2800000000000002 111.682 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -142.19 11.75 1.97 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.396 -0.366 . . . . 3.1699999999999999 111.079 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' ASP . 32.2 pttt -125.61 144.65 50.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.897 0.379 . . . . 2.9100000000000001 111.226 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 40.2 mt -98.41 105.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.063 -0.517 . . . . 2.2599999999999998 109.681 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mt -87.0 103.09 12.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.964 -0.384 . . . . 3.1000000000000001 109.964 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.512 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.2 mp -80.07 125.26 29.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.075 -0.512 . . . . 2.4399999999999999 109.701 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -127.43 156.5 42.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.776 -0.647 . . . . 5.3899999999999997 110.107 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.603 ' HD3' HD11 ' A' ' 26' ' ' LEU . 26.3 mttp -102.66 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.144 -0.48 . . . . 4.1399999999999997 110.112 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.94 154.08 42.67 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.411 -0.588 . . . . 5.4199999999999999 109.411 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -104.03 103.1 35.91 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.632 -0.258 . . . . 4.54 110.986 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.33 -2.17 9.93 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.888 2.392 . . . . 5.0199999999999996 113.021 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -102.22 22.32 13.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 6.6799999999999997 110.698 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 21.3 mmt -84.99 -46.8 10.87 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.233 0.54 . . . . 6.4699999999999998 109.79 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 28.31 2.05 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.626 -0.716 . . . . 5.7699999999999996 110.178 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.1 m 65.58 91.65 0.08 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.485 -0.779 . . . . 4.5499999999999998 111.368 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 . . . . . 0 N--CA 1.466 0.327 0 CA-C-N 115.652 -0.704 . . . . 6.7999999999999998 111.008 179.701 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.3 tpp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 121.737 0.779 . . . . 10.279999999999999 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.43 ' HB3' ' H ' ' B' ' 3' ' ' SER . 40.8 mmtt -82.73 -154.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.167 -0.924 . . . . 9.0299999999999994 110.245 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . 0.503 ' HA ' HD11 ' B' ' 6' ' ' ILE . 5.5 m -65.63 87.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.392 0.615 . . . . 6.5800000000000001 110.799 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.88 78.57 1.17 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.578 -0.737 . . . . 5.3399999999999999 111.109 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . 0.525 ' HA2' ' HA ' ' A' ' 37' ' ' TYR . . . 91.62 51.56 2.48 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.509 -0.853 . . . . 4.1100000000000003 112.837 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' B' ' 3' ' ' SER . 7.8 pt -153.25 177.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.681 0.277 . . . . 4.25 111.096 -178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' GLU . 6.6 m -73.65 135.03 28.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.861 -0.609 . . . . 3.3199999999999998 110.233 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' B' ' 9' ' ' LYS . 3.3 tmt_? -134.62 135.13 41.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.118 -0.492 . . . . 4.4699999999999998 109.726 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.432 ' O ' ' HD3' ' B' ' 8' ' ' ARG . 12.7 tmtt? -58.79 131.23 50.32 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.271 -0.64 . . . . 3.3999999999999999 109.271 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.463 HG23 ' HA ' ' A' ' 33' ' ' ALA . 38.7 t -75.41 -86.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.617 -0.433 . . . . 3.48 110.062 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -174.55 162.43 3.43 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.764 -0.458 . . . . 4.5199999999999996 109.764 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mp0 -75.91 -24.93 55.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 4.8899999999999997 110.166 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 34.6 mt -104.7 -48.6 3.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 3.8199999999999998 110.38 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 133.93 38.3 0.21 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.737 -0.744 . . . . 2.7000000000000002 112.354 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 17' ' ' VAL . 14.9 mtm180 -107.58 147.53 30.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.799 0.333 . . . . 3.7799999999999998 110.542 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.62 104.36 15.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 3.0 109.716 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -90.32 98.46 8.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.409 0.623 . . . . 2.9100000000000001 111.105 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -77.02 130.98 73.92 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.601 -0.727 . . . . 2.4399999999999999 109.899 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' B' ' 23' ' ' ARG . 93.8 Cg_exo -43.65 121.7 2.86 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.17 2.58 . . . . 2.5699999999999998 112.479 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 25.3 pt -74.33 -25.71 19.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 4.2800000000000002 111.716 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' B' ' 21' ' ' GLU . 1.1 mp0 -62.79 -57.26 11.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.137 0.494 . . . . 4.7400000000000002 109.685 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' B' ' 26' ' ' LEU . 68.3 mt -63.66 -34.32 77.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.695 -0.684 . . . . 3.6499999999999999 109.895 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 19' ' ' PRO . 7.6 ttm180 -61.29 -43.79 98.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.327 -0.851 . . . . 3.98 110.739 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 4.7999999999999998 110.131 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 4.8 m -69.86 -26.66 64.31 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.49 0.662 . . . . 4.4100000000000001 109.38 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' B' ' 22' ' ' LEU . 39.4 mt -83.46 -61.61 1.8 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.391 -0.822 . . . . 4.8499999999999996 109.694 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.38 46.86 54.66 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 121.121 -0.562 . . . . 3.6899999999999999 112.68 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pt -115.2 -176.39 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.376 0.088 . . . . 4.0099999999999998 110.774 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.55 90.93 0.76 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.962 0.411 . . . . 4.4299999999999997 111.567 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -80.18 -37.19 33.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.755 -0.657 . . . . 5.5599999999999996 110.175 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -98.08 57.15 1.25 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 4.4699999999999998 110.389 -179.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -148.4 -58.82 0.24 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.875 -0.602 . . . . 3.96 110.299 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.446 ' HB1' ' CG1' ' A' ' 7' ' ' VAL . . . -164.74 135.08 3.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.001 0.429 . . . . 1.98 111.247 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.558 HD12 HG21 ' A' ' 10' ' ' VAL . 32.5 mt -128.15 156.5 42.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.632 -0.713 . . . . 2.3999999999999999 109.487 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' B' ' 46' ' ' LYS . 5.7 mt-10 -87.07 112.16 21.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.021 0.439 . . . . 3.0 111.355 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mm -118.63 92.01 2.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.388 -0.597 . . . . 2.5 109.388 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.564 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 36.2 t80 -92.83 80.47 4.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.981 -0.554 . . . . 4.3899999999999997 111.382 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.542 ' H ' ' HA2' ' A' ' 5' ' ' GLY . 20.8 t -86.74 96.35 5.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.896 -0.593 . . . . 3.6000000000000001 109.819 178.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -119.28 82.19 1.83 Allowed 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.758 -0.377 . . . . 4.7400000000000002 111.078 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.31 -88.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.313 -0.858 . . . . 5.3799999999999999 112.951 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.446 ' HA ' ' NZ ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -90.81 -47.9 7.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.25 0.463 . . . . 3.7599999999999998 112.25 -178.296 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -86.49 129.69 34.77 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.219 0.533 . . . . 4.3499999999999996 111.888 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 10.6 mt -122.11 93.85 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.142 -0.688 . . . . 2.4199999999999999 109.142 178.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.564 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 58.8 mt -85.35 120.66 36.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.08 0.467 . . . . 2.6899999999999999 111.864 -178.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp -107.33 126.13 52.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.61 -0.723 . . . . 2.3599999999999999 109.569 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' B' ' 35' ' ' GLU . 11.3 ttmt -133.67 167.69 20.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.785 0.326 . . . . 3.21 110.484 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.65 -174.51 0.57 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.687 0.756 . . . . 3.6600000000000001 112.996 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -62.14 114.13 3.25 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.448 -1.251 . . . . 5.2000000000000002 112.489 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -142.35 93.3 7.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.1 -32.84 33.4 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.912 2.408 . . . . 3.8100000000000001 113.496 -178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 62.73 -165.12 0.24 Allowed 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.447 0.467 . . . . 5.2000000000000002 110.393 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 16.1 tpt -112.2 98.7 7.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.978 0.418 . . . . 6.1900000000000004 110.621 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -171.07 1.96 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.174 -0.466 . . . . 5.4199999999999999 110.991 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . 0.476 ' HB3' ' OXT' ' D' ' 55' ' ' GLN . 37.1 m -77.58 62.47 2.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.652 0.739 . . . . 5.5199999999999996 110.63 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.52 -0.764 . . . . 6.3799999999999999 110.594 -179.619 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.6 ' SD ' ' HD3' ' C' ' 8' ' ' ARG . 3.2 ptt? . . . . . 0 N--CA 1.456 -0.131 0 N-CA-C 109.712 -0.477 . . . . 7.7999999999999998 109.712 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -109.39 157.93 18.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.919 0.39 . . . . 8.5700000000000003 110.605 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . 0.41 ' OG ' HD11 ' C' ' 22' ' ' LEU . 19.3 m -97.97 43.33 1.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.318 0.58 . . . . 5.0099999999999998 110.883 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.04 24.98 3.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.199 0.523 . . . . 4.25 110.698 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.19 48.18 2.68 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 110.903 -0.879 . . . . 2.4700000000000002 110.903 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 42.9 mm -107.12 137.45 37.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.669 -0.265 . . . . 3.96 110.748 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.414 HG22 ' H ' ' C' ' 7' ' ' VAL . 0.8 OUTLIER -75.49 105.16 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.352 0.596 . . . . 2.5299999999999998 110.486 179.295 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . 0.6 ' HD3' ' SD ' ' C' ' 1' ' ' MET . 23.2 tpt180 -86.43 119.01 26.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.513 -0.767 . . . . 3.6000000000000001 110.468 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 tttm -70.24 136.34 49.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.236 -0.438 . . . . 2.6400000000000001 110.318 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 t -69.77 138.76 21.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.205 -0.665 . . . . 2.7000000000000002 109.205 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -73.51 150.38 41.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.426 -0.352 . . . . 3.5699999999999998 110.379 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -56.89 -24.12 49.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.083 -0.508 . . . . 3.21 111.952 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -78.56 2.94 17.52 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 122.16 -0.337 . . . . 3.3900000000000001 111.473 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.06 30.48 42.28 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 121.199 -0.524 . . . . 3.1600000000000001 112.988 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' OD2' ' D' ' 11' ' ' ASP . 3.7 mtm180 -143.89 -179.34 6.41 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.359 -0.608 . . . . 5.0499999999999998 109.359 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.483 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 45.4 t -122.38 120.18 60.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 119.883 -0.727 . . . . 2.6400000000000001 111.41 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . 0.407 HG22 ' HG2' ' D' ' 15' ' ' ARG . 6.0 t -71.7 121.62 22.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 110.175 -0.306 . . . . 3.4399999999999999 110.175 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.7 mt -81.2 128.92 68.93 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 3.3399999999999999 110.133 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.1 137.43 23.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.946 2.431 . . . . 2.6600000000000001 112.505 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 10.2 pt -59.24 -36.49 63.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 4.46 111.624 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -60.93 -44.08 97.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.587 -0.278 . . . . 4.1799999999999997 110.993 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.41 HD11 ' OG ' ' C' ' 3' ' ' SER . 46.2 mt -62.97 -42.5 99.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.772 0.32 . . . . 3.5299999999999998 110.643 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.455 ' CZ ' ' HA3' ' D' ' 14' ' ' GLY . 10.5 mtp180 -62.85 -34.44 77.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 4.2199999999999998 110.358 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' C' ' 24' ' ' ARG . 0.0 OUTLIER -72.66 -41.14 65.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.966 -0.561 . . . . 5.04 110.858 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -70.28 -35.94 74.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.414 -0.357 . . . . 4.29 111.772 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.73 -20.79 59.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.609 -0.269 . . . . 5.0199999999999996 111.464 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.65 38.97 95.14 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.604 -0.808 . . . . 4.0800000000000001 111.45 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 27.2 pt -102.62 171.48 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.799 0.333 . . . . 4.4699999999999998 110.804 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.97 -175.85 3.27 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.115 -0.493 . . . . 3.6899999999999999 110.553 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.446 ' HB3' ' H71' ' F' ' 7' ' ' ' DT' . 0.1 OUTLIER -72.2 -43.61 64.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.29 -0.414 . . . . 5.5800000000000001 110.267 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' C' ' 30' ' ' GLU . 0.5 OUTLIER -111.44 47.04 1.04 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.124 0.488 . . . . 5.1399999999999997 109.875 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -80.88 -163.43 0.59 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.631 -0.713 . . . . 2.8199999999999998 110.9 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.25 134.38 43.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.034 0.445 . . . . 2.2599999999999998 111.432 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 72.2 mt -124.21 125.25 44.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.895 -0.593 . . . . 2.6600000000000001 109.51 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 0.1 OUTLIER -76.14 130.06 37.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.002 0.43 . . . . 2.25 111.919 -178.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 35.3 pt -114.02 139.13 41.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.831 -0.622 . . . . 2.2400000000000002 110.948 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' D' ' 3' ' ' SER . 35.6 t80 -145.76 152.85 40.22 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.689 -0.687 . . . . 2.3999999999999999 110.508 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 86.5 t -82.93 134.88 25.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.69 0.281 . . . . 2.5499999999999998 110.396 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -129.32 91.82 3.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.599 0.238 . . . . 2.29 110.899 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 23.3 t70 65.78 -80.89 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.629 -0.714 . . . . 3.0 111.849 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -136.01 6.08 3.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 3.1400000000000001 110.525 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -128.27 174.18 9.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.585 -0.524 . . . . 2.96 109.585 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.94 138.7 39.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-O 120.548 0.214 . . . . 2.3199999999999998 110.467 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . 0.584 HG22 HD13 ' D' ' 44' ' ' ILE . 19.7 pt -116.14 124.29 72.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.171 0.51 . . . . 2.27 110.845 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 mp -109.79 154.75 22.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.681 -0.69 . . . . 2.4399999999999999 109.619 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -160.71 -178.98 7.23 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.397 -0.594 . . . . 3.02 109.397 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.57 170.15 5.38 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.248 0.342 . . . . 2.96 110.136 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -59.67 115.47 3.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.357 0.599 . . . . 4.2000000000000002 110.579 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -93.14 138.04 23.38 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.541 -0.754 . . . . 3.2400000000000002 110.812 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.33 127.77 21.91 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.663 2.242 . . . . 3.5 111.477 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -155.4 117.03 4.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.531 -0.304 . . . . 3.7200000000000002 110.879 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 1.9 tpt -133.04 -163.75 1.39 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.805 -0.443 . . . . 6.0099999999999998 109.805 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.97 -77.38 0.35 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.917 0.34 . . . . 5.6200000000000001 111.917 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 34.3 m -80.04 -45.58 18.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.886 0.374 . . . . 4.1200000000000001 111.417 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.18 -0.464 . . . . 5.3099999999999996 110.119 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . 0.417 ' N ' ' HB2' ' A' ' 21' ' ' GLU . 2.0 mpt? . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.818 0.342 . . . . 3.6899999999999999 110.236 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -72.54 154.27 40.89 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.123 -0.49 . . . . 3.5699999999999998 110.847 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 31.0 m -90.48 38.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.115 0.483 . . . . 2.6400000000000001 110.943 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.81 38.06 1.25 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.293 0.568 . . . . 2.4399999999999999 110.116 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . 0.491 ' N ' ' HD1' ' C' ' 37' ' ' TYR . . . 82.51 50.48 4.73 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.006 -0.837 . . . . 1.9199999999999999 111.006 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 74.2 mt -115.25 140.59 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.838 0.352 . . . . 2.4500000000000002 111.45 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 0.0 OUTLIER -77.95 113.76 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.849 -0.614 . . . . 2.6099999999999999 110.486 179.242 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.684 ' NH1' ' HB ' ' D' ' 17' ' ' VAL . 0.0 OUTLIER -99.43 129.23 45.6 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.621 -0.718 . . . . 2.77 111.02 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -66.66 146.49 54.42 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.193 -0.458 . . . . 3.1499999999999999 111.479 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 12.4 t -84.88 158.07 3.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 3.0800000000000001 110.035 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.493 ' OD2' ' HD2' ' C' ' 15' ' ' ARG . 6.9 t0 -85.46 167.32 15.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 4.5899999999999999 112.166 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -37.49 84.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.452 -0.794 . . . . 6.0599999999999996 111.738 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.45 ' HB2' ' CZ ' ' D' ' 15' ' ' ARG . 0.8 OUTLIER -86.89 10.15 17.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.884 0.373 . . . . 4.8399999999999999 110.256 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' C' ' 23' ' ' ARG . . . 74.08 33.53 56.96 Favored Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 110.511 -1.035 . . . . 3.4300000000000002 110.511 -178.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.489 ' H ' ' HB3' ' D' ' 11' ' ' ASP . 6.0 mtm180 -103.25 163.43 12.25 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.215 -0.493 . . . . 4.5099999999999998 110.163 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.483 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 3.8 p -94.47 112.31 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 N-CA-C 107.664 -1.236 . . . . 2.75 107.664 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.684 ' HB ' ' NH1' ' D' ' 8' ' ' ARG . 21.7 t -76.24 86.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.523 -0.762 . . . . 3.3599999999999999 110.219 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 28.2 mt -65.05 119.86 62.15 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.176 -0.676 . . . . 3.0800000000000001 109.176 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' D' ' 23' ' ' ARG . 93.5 Cg_exo -44.63 138.19 8.14 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.605 2.87 . . . . 3.46 112.441 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 42.1 pt -56.46 -33.12 38.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.64 . . . . 4.8200000000000003 111.619 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -37.05 59.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.858 -0.337 . . . . 4.9800000000000004 110.88 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.427 ' HA ' HD23 ' D' ' 22' ' ' LEU . 12.7 mt -66.45 -39.75 89.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.71 0.29 . . . . 3.25 110.228 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' D' ' 19' ' ' PRO . 59.8 mtm-85 -61.99 -41.74 98.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 2.8799999999999999 109.972 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 ttp-105 -69.48 -30.56 68.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.906 -0.588 . . . . 6.0999999999999996 110.632 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 44.5 m -70.32 -47.43 61.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.916 -0.583 . . . . 3.73 111.153 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.62 -22.3 50.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.184 -0.462 . . . . 2.9700000000000002 110.739 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.38 35.66 59.84 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.769 -0.729 . . . . 2.79 111.865 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -95.53 130.76 43.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.965 0.412 . . . . 2.1499999999999999 110.798 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.41 168.25 12.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.05 -0.523 . . . . 2.46 109.81 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.475 ' H ' ' CD ' ' D' ' 30' ' ' GLU . 0.9 OUTLIER -77.17 12.68 1.36 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.936 0.398 . . . . 3.3999999999999999 111.121 -179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -131.31 7.65 4.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.276 -0.42 . . . . 3.4399999999999999 110.728 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -87.7 -164.98 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 2.6600000000000001 110.055 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . 0.58 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -143.33 158.94 43.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.91 0.386 . . . . 2.2999999999999998 111.253 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.414 ' CD2' ' HA ' ' D' ' 47' ' ' LYS . 30.7 mt -135.21 131.3 36.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 2.1099999999999999 109.739 179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 33.7 tt0 -74.92 109.12 8.12 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.569 -0.53 . . . . 2.3399999999999999 109.569 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . 0.407 HG12 HD12 ' D' ' 45' ' ' LEU . 19.4 mt -100.58 118.92 47.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.47 0.652 . . . . 2.3300000000000001 112.182 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . 0.486 ' HB3' ' HB ' ' D' ' 44' ' ' ILE . 20.4 t80 -122.28 175.65 6.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.86 -1.163 . . . . 2.2400000000000002 107.86 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 p -133.98 136.8 53.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 118.301 0.501 . . . . 2.1400000000000001 110.974 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 15.7 t70 -126.06 99.37 5.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.931 -0.577 . . . . 1.99 110.315 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 33.7 t70 65.97 -84.27 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.549 -0.751 . . . . 2.7599999999999998 111.635 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -130.76 3.46 4.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 2.3500000000000001 111.299 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 31.7 pttt -115.14 149.09 38.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.156 0.503 . . . . 2.3399999999999999 111.283 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 14.2 mt -89.83 132.47 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.365 -0.834 . . . . 1.99 109.942 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . 0.584 HD13 HG22 ' C' ' 44' ' ' ILE . 37.5 mm -97.97 111.67 28.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.939 -0.573 . . . . 2.0 109.885 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . 0.407 HD12 HG12 ' D' ' 36' ' ' ILE . 16.7 tp -104.58 103.1 12.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.233 -0.44 . . . . 2.77 110.836 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.459 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 52.0 mtpt -103.68 130.36 51.15 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.929 -0.578 . . . . 2.3599999999999999 109.789 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . 0.414 ' HA ' ' CD2' ' D' ' 34' ' ' LEU . 21.8 pttm -69.04 151.81 46.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.539 -0.3 . . . . 2.9900000000000002 110.498 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 2.5 p90 -57.26 152.26 14.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.064 -0.516 . . . . 3.2599999999999998 110.367 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -114.68 88.32 16.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.915 0.388 . . . . 5.0300000000000002 111.191 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -83.56 -3.4 10.68 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.922 2.414 . . . . 3.73 111.649 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 31.9 t30 58.43 58.69 3.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.197 -0.91 . . . . 4.6200000000000001 110.408 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 98.4 mmm -129.5 166.26 20.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.81 -0.632 . . . . 5.29 110.882 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.48 -169.29 2.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.152 -0.476 . . . . 5.8300000000000001 110.349 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.31 176.36 2.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.802 0.334 . . . . 4.5199999999999996 110.737 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . 0.476 ' OXT' ' HB3' ' B' ' 54' ' ' CYS . 21.5 tp60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.655 -0.688 . . . . 7.0 110.512 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.706 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 107.068 0.88 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.706 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.808 0 N19-C1'-C2' 117.44 2.025 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.753 H2'' ' N7 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O3'-P-O5' 100.931 -1.615 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.753 ' N7 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 109.731 2.414 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.541 ' H72' " C2'" ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C1'-N19 109.227 1.784 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.656 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O3'-P-O5' 100.378 -1.906 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.656 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 109.716 2.395 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.545 ' C8 ' " H1'" ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.143 1.679 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.714 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.527 0.443 0 O3'-P-O5' 100.141 -2.031 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.714 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 O4'-C1'-N19 109.568 2.21 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.575 ' C8 ' " H1'" ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.76 0 O4'-C1'-N19 109.504 2.13 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.537 ' C6 ' H2'' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.613 -2.309 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.661 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.864 0 O3'-P-O5' 99.544 -2.345 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.661 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.691 0 O4'-C1'-N19 109.386 1.982 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.529 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.688 0 O4'-C1'-N19 109.905 2.631 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.569 " H1'" ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O3'-P-O5' 99.88 -2.169 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.672 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.675 0 O3'-P-O5' 99.854 -2.182 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.672 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.963 0 O4'-C1'-N19 109.835 2.544 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.477 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.921 0 O4'-C1'-N19 109.345 1.931 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.475 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.5 2.125 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.523 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.422 -0.666 0 O4'-C1'-N19 109.421 2.027 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.523 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.923 0 O4'-C1'-N19 109.663 2.329 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.51 H2'' ' C6 ' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.676 0 O3'-P-O5' 99.449 -2.395 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.7 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.618 0 N19-C1'-C2' 117.317 1.948 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.7 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.595 -1.002 0 N19-C1'-C2' 116.269 1.293 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.731 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O5'-C5'-C4' 111.589 0.992 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.731 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.954 0 N19-C1'-C2' 116.976 1.735 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.629 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 110.224 3.03 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.518 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-N19 109.587 2.234 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.537 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.78 0 O4'-C1'-N19 110.039 2.798 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.537 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 109.936 2.67 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.482 ' H72' " C2'" ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O3'-P-O5' 99.447 -2.396 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.608 H2'' ' C5 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.477 0 O3'-P-O5' 100.145 -2.029 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.608 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.055 2.818 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.447 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.51 2.138 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.407 H2'' ' C6 ' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.798 0 O3'-P-O5' 99.924 -2.145 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.634 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.78 0 O3'-P-O5' 99.951 -2.131 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.634 ' C8 ' H2'' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.811 2.514 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.617 H2'' ' C7 ' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.418 -1.002 0 O3'-P-O5' 99.214 -2.519 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.617 ' C7 ' H2'' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.884 0 O4'-C1'-N19 110.048 2.81 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.737 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.931 0 N19-C1'-C2' 118.168 2.48 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.737 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.425 3.282 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.433 ' H72' " C2'" ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.422 -0.684 0 O3'-P-O5' 99.057 -2.602 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.927 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.999 0 N19-C1'-C2' 118.093 2.433 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.927 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 109.332 1.915 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.695 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.484 2.106 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.703 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.679 0 O3'-P-O5' 100.233 -1.983 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.703 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.159 1.85 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.64 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.711 0 O4'-C4'-C3' 104.444 -1.156 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 N19-C1'-C2' 116.523 1.452 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.818 0.342 . . . . 9.4199999999999999 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -106.22 167.98 9.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.178 0.513 . . . . 10.67 111.458 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.4 2.88 3.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.233 -0.894 . . . . 7.75 112.108 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -20.0 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.041 0.448 . . . . 5.6600000000000001 110.884 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 36' ' ' ILE . . . 105.5 139.11 9.6 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.759 -0.734 . . . . 3.5699999999999998 112.473 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.9 tp -146.25 130.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 120.943 0.402 . . . . 4.6799999999999997 110.691 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG21 ' SD ' ' B' ' 52' ' ' MET . 13.4 t -81.16 117.53 27.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.145 -0.479 . . . . 3.27 109.905 179.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.52 130.07 55.65 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.996 -0.547 . . . . 4.4500000000000002 110.198 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.64 124.41 31.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.194 0.521 . . . . 2.8900000000000001 111.05 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.476 ' HB ' ' O ' ' B' ' 32' ' ' ASP . 51.8 t -104.67 114.61 44.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.046 -0.724 . . . . 2.9399999999999999 109.046 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.7 -164.65 0.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.171 -0.468 . . . . 4.4400000000000004 110.527 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.58 49.51 0.3 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.591 0.71 . . . . 3.6099999999999999 110.037 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.557 HD11 ' C5 ' ' F' ' 17' ' ' ' DG' . 1.3 mm? -112.88 -34.61 5.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.59 -1.187 . . . . 4.3499999999999996 110.785 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' C ' ' HE ' ' A' ' 15' ' ' ARG . . . 73.19 5.32 65.94 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.95 -0.643 . . . . 2.0899999999999999 111.894 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' NH1' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -105.22 129.34 53.62 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 110.18 -0.304 . . . . 3.6099999999999999 110.18 -179.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' B' ' 16' ' ' VAL . 91.5 t -95.59 110.65 24.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 120.186 -0.606 . . . . 2.3300000000000001 110.377 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.26 109.52 11.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.791 -0.64 . . . . 2.4100000000000001 110.57 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 tp -86.45 134.6 37.77 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.898 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -54.01 125.39 18.59 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.7 2.267 . . . . 2.71 111.426 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 tp -66.48 -31.74 54.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.954 -0.566 . . . . 3.73 112.12 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' D' ' 21' ' ' GLU . 2.6 tt0 -63.27 -52.48 61.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.167 0.508 . . . . 4.3099999999999996 110.073 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 68.3 mt -66.49 -43.8 84.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.47 -0.786 . . . . 3.5800000000000001 111.16 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.527 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.7 tmm_? -56.07 -45.72 79.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 2.9500000000000002 111.637 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -71.34 -29.83 65.46 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.069 -0.252 . . . . 3.8700000000000001 111.583 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.9 m -73.82 -29.67 62.28 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.898 0.38 . . . . 4.0899999999999999 110.705 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 73.7 mt -72.23 -18.69 61.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.95 0.405 . . . . 4.4900000000000002 111.14 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.85 32.61 7.47 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.786 -0.721 . . . . 3.7400000000000002 113.165 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -119.1 141.93 36.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.968 0.413 . . . . 4.1100000000000003 110.62 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.06 -164.56 1.15 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.939 -0.573 . . . . 4.9900000000000002 111.358 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' O ' HG21 ' B' ' 10' ' ' VAL . 5.0 mp0 -67.25 -62.84 1.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.274 -0.421 . . . . 6.1699999999999999 111.32 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.52 ' HA ' HG11 ' B' ' 10' ' ' VAL . 64.6 mmtt -87.24 97.56 10.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.247 -0.433 . . . . 4.1200000000000001 110.965 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.32 -166.44 2.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.179 -0.464 . . . . 3.98 110.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.81 140.04 31.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.476 -0.329 . . . . 2.9500000000000002 110.217 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.3 mt -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.666 0.269 . . . . 2.9500000000000002 110.763 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HG2' HG22 ' B' ' 7' ' ' VAL . 14.1 mt-10 -96.2 107.33 19.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 3.5099999999999998 109.992 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 95.9 mt -92.65 116.07 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.028 -0.533 . . . . 2.75 111.633 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -119.04 114.25 22.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.723 -0.671 . . . . 6.1299999999999999 109.964 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 t -86.48 115.18 27.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.121 0.486 . . . . 3.1800000000000002 111.659 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -110.14 86.85 2.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.106 -0.701 . . . . 3.6800000000000002 109.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 66.04 -87.75 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.59 -0.732 . . . . 4.2800000000000002 110.95 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.93 1.5 10.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 3.1699999999999999 110.528 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -106.7 126.2 51.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.305 -0.407 . . . . 2.9100000000000001 110.837 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.4 mt -97.31 96.93 5.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.651 -0.5 . . . . 2.2599999999999998 109.651 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.2 mt -84.75 115.43 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.05 -0.523 . . . . 3.1000000000000001 110.954 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.417 HD21 HG11 ' B' ' 16' ' ' VAL . 7.5 mp -101.63 107.39 18.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.674 -0.693 . . . . 2.4399999999999999 111.058 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . 90.8 mttt -91.84 150.43 21.07 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.806 -0.813 . . . . 5.3899999999999997 108.806 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.79 158.65 43.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.852 0.358 . . . . 4.1399999999999997 111.303 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -88.64 155.07 19.82 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.717 -0.845 . . . . 5.4199999999999999 108.717 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 76.9 65.07 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 4.54 111.288 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.44 -22.69 44.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.352 2.034 . . . . 5.0199999999999996 112.315 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -74.47 -15.57 60.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 6.6799999999999997 110.748 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 68.3 mtt -102.97 16.09 27.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 6.4699999999999998 110.487 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.12 42.01 3.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 5.7699999999999996 110.885 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.6 t -77.78 99.26 5.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.065 0.46 . . . . 4.5499999999999998 110.102 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.712 -0.676 . . . . 6.7999999999999998 111.443 -179.343 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mmm . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.095 0.474 . . . . 10.279999999999999 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 96.14 4.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.008 -0.542 . . . . 9.0299999999999994 110.599 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.77 88.7 4.01 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.017 -0.538 . . . . 6.5800000000000001 111.318 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -89.98 95.34 10.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.244 0.545 . . . . 5.3399999999999999 110.723 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.26 50.98 2.86 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.272 -0.731 . . . . 4.1100000000000003 111.272 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -100.46 134.59 39.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.973 0.416 . . . . 4.25 111.148 -178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.646 HG22 ' HG2' ' A' ' 35' ' ' GLU . 25.5 t -92.12 103.89 15.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.156 0.503 . . . . 3.3199999999999998 109.699 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' B' ' 8' ' ' ARG . 5.4 mmt180 -102.3 144.2 31.1 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.702 -0.681 . . . . 4.4699999999999998 110.952 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' B' ' 10' ' ' VAL . 0.0 OUTLIER -78.43 170.11 17.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.658 -0.701 . . . . 3.3999999999999999 110.673 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 31' ' ' LYS . 5.7 p -71.04 156.14 7.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.242 0.544 . . . . 3.48 111.361 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' B' ' 15' ' ' ARG . 18.0 t70 -71.88 -43.85 64.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.744 -0.662 . . . . 4.5199999999999996 110.285 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -178.01 -63.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.289 -0.868 . . . . 4.8899999999999997 109.236 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.476 ' HA ' HD13 ' B' ' 13' ' ' LEU . 1.9 mm? -116.4 -108.87 0.36 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.731 -0.668 . . . . 3.8199999999999998 109.92 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.71 67.52 0.49 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.7 -0.762 . . . . 2.7000000000000002 111.74 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.471 ' HB2' ' HB3' ' B' ' 11' ' ' ASP . 4.1 mpp_? -142.08 131.84 24.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.574 0.226 . . . . 3.7799999999999998 110.52 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.557 ' HB ' ' HB ' ' A' ' 16' ' ' VAL . 53.4 t -86.71 132.41 32.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 CA-C-O 121.11 0.481 . . . . 3.0 110.433 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.464 HG22 ' NH1' ' A' ' 15' ' ' ARG . 74.5 t -97.26 112.04 28.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.25 -0.887 . . . . 2.9100000000000001 112.029 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 tt -96.84 132.8 25.32 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.447 -0.575 . . . . 2.4399999999999999 109.447 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -51.08 135.69 44.75 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.465 2.776 . . . . 2.5699999999999998 113.61 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.5 ' HB ' " C5'" ' E' ' 7' ' ' ' DG' . 8.5 tt -61.18 -39.32 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 115.613 -0.722 . . . . 4.2800000000000002 111.722 -179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.52 -38.07 80.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.057 -0.52 . . . . 4.7400000000000002 111.307 -179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.04 -33.57 74.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.193 -0.458 . . . . 3.6499999999999999 110.877 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -11.85 58.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.927 0.394 . . . . 3.98 110.966 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -87.76 -20.61 25.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.968 -0.56 . . . . 4.7999999999999998 109.996 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 2.3 p -109.58 -57.57 2.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.974 -0.557 . . . . 4.4100000000000001 111.491 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.439 ' HG ' ' N ' ' B' ' 27' ' ' GLY . 7.2 tp -87.38 156.1 19.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.78 -0.645 . . . . 4.8499999999999996 110.423 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . 0.439 ' N ' ' HG ' ' B' ' 26' ' ' LEU . . . 140.21 155.05 6.43 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.674 -0.774 . . . . 3.6899999999999999 112.137 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . 0.486 ' HB ' ' OD1' ' B' ' 32' ' ' ASP . 7.4 mt -107.7 -53.61 6.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 4.0099999999999998 109.331 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -140.61 -167.38 2.34 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.307 -0.861 . . . . 4.4299999999999997 109.169 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.25 -22.59 25.12 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.905 -0.776 . . . . 5.5599999999999996 108.905 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -111.29 63.01 0.61 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.025 -0.989 . . . . 4.4699999999999998 109.096 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.486 ' OD1' ' HB ' ' B' ' 28' ' ' ILE . 51.2 m-20 -76.31 128.84 35.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.058 -0.519 . . . . 3.96 111.864 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.08 136.54 36.4 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.818 -0.808 . . . . 1.98 108.818 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -124.45 147.55 48.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.091 0.472 . . . . 2.3999999999999999 111.422 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 14.1 tm-20 -97.9 116.77 30.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.638 -0.71 . . . . 3.0 109.534 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.522 ' O ' ' HA2' ' A' ' 5' ' ' GLY . 52.9 mt -92.35 101.34 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 116.112 -0.495 . . . . 2.5 110.945 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -114.41 119.45 36.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.978 -0.555 . . . . 4.3899999999999997 110.706 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 96.6 t -94.0 113.36 28.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.267 -0.424 . . . . 3.6000000000000001 110.041 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' B' ' 42' ' ' LYS . 12.2 t70 -112.81 119.2 37.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.94 -0.573 . . . . 4.7400000000000002 109.931 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t0 66.03 -76.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 O-C-N 123.853 0.72 . . . . 5.3799999999999999 110.133 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.74 8.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.774 0.321 . . . . 3.7599999999999998 110.415 178.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 20.7 pttm -111.3 157.21 20.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.329 -0.396 . . . . 4.3499999999999996 110.125 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.83 105.71 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.767 0.318 . . . . 2.4199999999999999 110.949 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.7 mt -95.28 112.82 28.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.785 -0.45 . . . . 2.6899999999999999 109.785 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 8.0 mp -95.81 110.97 23.05 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.065 -0.516 . . . . 2.3599999999999999 111.157 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -103.05 -157.54 0.62 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.844 -0.798 . . . . 3.21 108.844 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 23.9 pttt -93.03 -56.12 3.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.313 -0.555 . . . . 3.6600000000000001 111.156 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -164.14 176.76 8.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 5.2000000000000002 111.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptmt -156.04 161.38 29.6 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.263 -0.643 . . . . 5.0999999999999996 109.263 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -43.3 -46.21 9.61 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.163 2.575 . . . . 3.8100000000000001 112.253 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -78.55 90.13 4.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.136 0.493 . . . . 5.2000000000000002 109.8 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . 0.408 ' SD ' HG21 ' A' ' 7' ' ' VAL . 85.5 mmm -85.68 -176.22 5.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.831 -0.622 . . . . 6.1900000000000004 110.384 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.77 142.63 55.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.058 0.456 . . . . 5.4199999999999999 111.753 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 62.8 m -87.13 162.46 17.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.826 -0.625 . . . . 5.5199999999999996 110.326 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.766 -0.197 . . . . 6.3799999999999999 110.676 179.905 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 58.0 mtp . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.216 0.531 . . . . 7.7999999999999998 110.42 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -132.49 29.13 4.27 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.666 -0.697 . . . . 8.5700000000000003 109.414 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -24.09 67.58 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.696 -0.684 . . . . 5.0099999999999998 111.606 -178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . 0.446 ' HA ' ' CE1' ' D' ' 37' ' ' TYR . 0.9 OUTLIER -97.14 17.38 17.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 4.25 111.074 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.34 87.81 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 111.908 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 12.1 mt -79.08 100.55 3.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.097 0.475 . . . . 3.96 110.451 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 2.6 m -79.52 101.76 5.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.859 -0.61 . . . . 2.5299999999999998 110.609 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 4.4 mmt85 -101.95 140.29 36.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.821 -0.627 . . . . 3.6000000000000001 110.003 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -77.68 152.67 33.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.859 -0.61 . . . . 2.6400000000000001 112.125 -178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.502 HG13 HG22 ' C' ' 16' ' ' VAL . 16.1 t -102.06 135.31 39.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.218 -0.901 . . . . 2.7000000000000002 108.696 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -84.61 158.71 20.79 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.726 0.298 . . . . 3.5699999999999998 110.985 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.29 -3.41 5.81 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.079 0.466 . . . . 3.21 111.14 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.521 ' HA ' ' H73' ' E' ' 16' ' ' ' DT' . 1.4 mm? -91.26 4.24 52.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.009 -0.541 . . . . 3.3900000000000001 109.909 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 18.71 79.91 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.986 -0.552 . . . . 3.1600000000000001 112.711 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.419 HH12 ' CD ' ' D' ' 12' ' ' GLU . 1.7 mtp85 -114.74 126.01 54.37 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.676 0.274 . . . . 5.0499999999999998 110.903 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.502 HG22 HG13 ' C' ' 10' ' ' VAL . 9.5 t -94.31 134.84 30.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.108 -0.497 . . . . 2.6400000000000001 109.858 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.31 99.64 4.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.333 -0.394 . . . . 3.4399999999999999 110.419 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.414 HG13 ' HD2' ' C' ' 19' ' ' PRO . 1.5 tp -67.45 145.21 98.32 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.792 -0.448 . . . . 3.3399999999999999 109.792 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' C' ' 18' ' ' ILE . 18.6 Cg_exo -68.26 91.2 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.053 1.836 . . . . 2.6600000000000001 110.919 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 9.0 tt -74.37 -5.92 7.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.781 -0.645 . . . . 4.46 110.715 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.18 -42.91 77.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.728 -0.669 . . . . 4.1799999999999997 111.424 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.42 -37.58 88.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.916 0.389 . . . . 3.5299999999999998 110.567 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.463 ' HD2' HD11 ' C' ' 28' ' ' ILE . 2.9 mtm180 -72.46 -37.46 68.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.232 0.539 . . . . 4.2199999999999998 109.851 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 26.8 ttm180 -61.53 -43.98 97.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.939 -1.028 . . . . 5.04 110.583 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 4.1 m -68.07 -33.33 74.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.673 -0.694 . . . . 4.29 111.41 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -78.85 -42.29 27.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 5.0199999999999996 111.247 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.54 38.14 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.908 -0.663 . . . . 4.0800000000000001 112.12 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . 0.463 HD11 ' HD2' ' C' ' 23' ' ' ARG . 12.3 pt -86.74 -172.5 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.743 0.306 . . . . 4.4699999999999998 110.834 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.46 160.74 24.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.064 -0.517 . . . . 3.6899999999999999 111.277 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.99 -24.47 16.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.251 -0.432 . . . . 5.5800000000000001 110.444 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -119.05 119.74 35.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.028 0.442 . . . . 5.1399999999999997 110.94 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . 0.512 ' H ' HG22 ' D' ' 10' ' ' VAL . 12.7 p-10 -161.31 -158.44 0.57 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.626 -0.715 . . . . 2.8199999999999998 109.569 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.55 162.2 36.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.793 0.33 . . . . 2.2599999999999998 111.248 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -132.82 148.41 52.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.122 -0.49 . . . . 2.6600000000000001 110.555 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -92.81 111.13 22.64 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.768 -0.456 . . . . 2.25 109.768 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 119.96 38.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.341 -0.39 . . . . 2.2400000000000002 111.735 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' D' ' 3' ' ' SER . 44.9 t80 -145.25 138.0 26.14 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 115.974 -0.557 . . . . 2.3999999999999999 109.856 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . 0.475 HG13 ' CB ' ' D' ' 3' ' ' SER . 0.2 OUTLIER -90.91 136.18 24.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.934 0.397 . . . . 2.5499999999999998 111.767 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -118.73 90.18 3.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.995 -0.743 . . . . 2.29 108.995 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.9 -56.57 0.66 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.327 -0.851 . . . . 3.0 110.905 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.05 -43.99 0.11 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 3.1400000000000001 109.916 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -73.12 143.14 47.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.82 -0.627 . . . . 2.96 109.938 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 16.9 mt -95.48 132.49 39.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 116.485 -0.325 . . . . 2.3199999999999998 110.499 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 35.1 mt -108.17 119.14 57.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.249 -0.432 . . . . 2.27 110.184 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 7.6 mp -105.94 91.27 3.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.627 -0.715 . . . . 2.4399999999999999 109.655 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -79.17 157.63 27.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.039 -0.528 . . . . 3.02 109.994 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -71.41 143.58 50.09 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.033 -0.729 . . . . 2.96 109.033 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -61.09 150.99 32.25 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.149 0.499 . . . . 4.2000000000000002 111.601 -178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.09 155.31 52.32 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.079 -0.711 . . . . 3.2400000000000002 109.079 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.75 62.36 2.32 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.453 2.102 . . . . 3.5 113.147 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -150.91 164.86 35.31 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.37 -0.604 . . . . 3.7200000000000002 109.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 41.8 ttm -124.58 -44.64 1.96 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.946 0.403 . . . . 6.0099999999999998 110.848 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.0 -173.42 2.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.157 -0.474 . . . . 5.6200000000000001 110.431 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 8.4 m -94.61 7.53 45.39 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.461 0.541 . . . . 4.1200000000000001 112.461 -178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 5.3099999999999996 110.873 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 C--O 1.227 -0.125 0 CA-C-O 121.211 0.529 . . . . 3.6899999999999999 110.062 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -91.1 155.05 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.939 -0.573 . . . . 3.5699999999999998 110.302 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' C' ' 37' ' ' TYR . 3.9 m -85.44 40.34 0.83 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.167 0.508 . . . . 2.6400000000000001 111.72 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.48 29.19 4.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.3 0.571 . . . . 2.4399999999999999 109.921 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.31 51.74 4.53 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.778 -0.929 . . . . 1.9199999999999999 110.778 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.45 137.31 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.615 0.245 . . . . 2.4500000000000002 110.955 -178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.64 122.22 35.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.237 -0.438 . . . . 2.6099999999999999 110.724 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.567 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 2.9 tmt_? -122.06 124.7 44.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.322 -0.622 . . . . 2.77 109.322 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 0.2 OUTLIER -64.56 151.0 45.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 3.1499999999999999 110.445 179.808 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.536 ' HB ' ' HA2' ' D' ' 14' ' ' GLY . 12.4 m -79.31 148.22 6.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.103 -0.703 . . . . 3.0800000000000001 109.103 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.42 -170.08 0.76 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.693 0.282 . . . . 4.5899999999999999 111.224 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.419 ' CD ' HH12 ' C' ' 15' ' ' ARG . 0.0 OUTLIER -48.28 -54.97 11.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.385 0.513 . . . . 6.0599999999999996 112.385 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -103.4 29.49 5.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.876 0.37 . . . . 4.8399999999999999 111.28 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . 0.536 ' HA2' ' HB ' ' D' ' 10' ' ' VAL . . . 76.68 13.82 83.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.877 -0.678 . . . . 3.4300000000000002 112.917 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 44.4 mtt-85 -67.55 151.21 47.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.87 0.366 . . . . 4.5099999999999998 111.607 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -108.77 147.51 13.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.997 -0.547 . . . . 2.75 109.645 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -133.19 155.07 40.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.91 0.386 . . . . 3.3599999999999999 111.239 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 pt -135.3 156.78 77.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.586 -0.734 . . . . 3.0800000000000001 109.505 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.39 143.85 75.09 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.825 2.35 . . . . 3.46 113.341 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.451 ' H ' HG13 ' D' ' 20' ' ' ILE . 6.9 mt -59.3 -56.83 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 115.369 -0.832 . . . . 4.8200000000000003 110.899 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 3.1 mt-10 -60.58 -27.87 68.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.218 -0.901 . . . . 4.9800000000000004 112.26 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 40.5 tp -57.76 -55.68 31.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.689 0.281 . . . . 3.25 110.455 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 68.4 mtm-85 -62.24 -38.57 89.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 2.8799999999999999 110.422 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -26.02 67.43 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.263 -0.88 . . . . 6.0999999999999996 111.634 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.33 -2.32 19.29 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.85 0.357 . . . . 3.73 111.614 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 11.3 mt -96.76 -31.05 12.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.721 0.296 . . . . 2.9700000000000002 110.558 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.85 25.8 8.88 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.312 -0.947 . . . . 2.79 112.1 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . 0.432 HG22 ' CE1' ' D' ' 48' ' ' TYR . 22.1 pt -122.63 133.3 69.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.8 0.333 . . . . 2.1499999999999999 110.201 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.04 162.09 17.0 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.285 -0.416 . . . . 2.46 111.047 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -76.42 -3.72 38.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.124 -0.489 . . . . 3.3999999999999999 110.891 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -116.46 58.46 0.76 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.345 0.593 . . . . 3.4399999999999999 110.057 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.15 -157.35 0.81 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.578 -0.737 . . . . 2.6600000000000001 109.737 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -142.45 152.82 43.14 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.89 -0.411 . . . . 2.2999999999999998 109.89 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.481 HD12 HG11 ' C' ' 16' ' ' VAL . 88.0 mt -123.84 137.96 54.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.655 0.264 . . . . 2.1099999999999999 111.134 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 76.9 tt0 -85.44 94.7 9.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.302 -0.999 . . . . 2.3399999999999999 108.302 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 22.7 mt -94.76 127.19 46.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.743 -0.662 . . . . 2.3300000000000001 111.7 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' C' ' 4' ' ' THR . 13.5 t80 -130.0 166.65 19.65 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.706 -0.679 . . . . 2.2400000000000002 109.616 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 6.3 p -114.81 131.2 67.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 120.85 0.357 . . . . 2.1400000000000001 110.199 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 10.7 t70 -118.08 89.05 3.04 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.684 -0.487 . . . . 1.99 109.684 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 37.2 t70 68.01 -81.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.376 -0.829 . . . . 2.7599999999999998 111.307 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -131.96 10.34 4.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.587 0.232 . . . . 2.3500000000000001 111.576 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 40.7 pttt -124.35 152.37 43.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.739 0.304 . . . . 2.3399999999999999 110.641 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 24.0 mt -94.4 137.68 22.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.218 -0.446 . . . . 1.99 110.504 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 24.2 mm -113.71 121.41 65.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.55 -0.296 . . . . 2.0 110.842 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 6.7 mp -108.41 102.52 11.61 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.348 -0.387 . . . . 2.77 110.049 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 47.4 mtpt -97.27 124.07 41.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.208 -0.451 . . . . 2.3599999999999999 111.167 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.15 161.45 14.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 2.9900000000000002 109.968 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.432 ' CE1' HG22 ' D' ' 28' ' ' ILE . 16.1 p90 -79.51 161.54 25.96 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.283 -0.266 . . . . 3.2599999999999998 110.283 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -87.79 110.82 37.93 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.113 -0.329 . . . . 5.0300000000000002 110.113 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.2 -35.59 13.98 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.743 2.295 . . . . 3.73 112.818 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 28.2 t30 62.72 26.53 15.68 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.277 0.56 . . . . 4.6200000000000001 110.691 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 46.0 tpp -149.92 152.66 35.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.95 -0.568 . . . . 5.29 110.249 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -59.1 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 5.8300000000000001 110.552 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.2 m -120.96 119.28 32.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.832 -0.622 . . . . 4.5199999999999996 110.342 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 117.962 -1.018 . . . . 7.0 111.145 179.78 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.701 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.701 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 117.627 2.142 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.688 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-N19 109.343 1.929 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-N19 109.469 2.086 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.53 ' H72' " C2'" ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.445 2.056 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.706 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 100.219 -1.99 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.706 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 109.624 2.28 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.525 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-N19 109.091 1.613 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.662 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.601 -0.482 0 O4'-C1'-N19 109.563 2.203 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.662 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-N19 109.516 2.145 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.471 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 109.758 2.448 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.598 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.527 0 O4'-C1'-N19 109.761 2.451 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.598 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 O4'-C1'-N19 109.607 2.259 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.595 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.614 2.268 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.542 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 110.031 2.788 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.542 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.639 0 O4'-C1'-N19 109.624 2.28 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.514 H2'' ' C8 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.735 0 O4'-C1'-N19 109.385 1.981 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.581 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.633 0 O4'-C1'-N19 109.734 2.417 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.581 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C1'-N19 109.425 2.032 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.445 2.057 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.502 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 O4'-C1'-N19 109.46 2.075 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.502 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.783 2.478 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.546 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 O3'-P-O5' 99.768 -2.227 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.623 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O3'-P-O5' 100.838 -1.664 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.623 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.9 0 N19-C1'-C2' 116.419 1.387 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.74 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O5'-C5'-C4' 111.362 0.83 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.74 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.621 1.143 0 N19-C1'-C2' 116.68 1.55 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.586 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 110.212 3.015 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.562 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.594 -1.094 0 O3'-P-O5' 99.471 -2.383 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.562 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 109.605 2.257 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.514 ' H72' " C2'" ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O3'-P-O5' 99.404 -2.419 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.538 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O3'-P-O5' 99.508 -2.364 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.56 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O3'-P-O5' 99.704 -2.261 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 O4'-C1'-N19 109.591 2.239 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.526 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.757 2.446 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.466 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.927 -2.144 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.466 ' H72' " C2'" ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C1'-N19 109.697 2.372 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.635 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.857 -2.18 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.635 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.859 0 O4'-C1'-N19 109.921 2.652 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.523 ' H72' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C1'-N19 109.64 2.3 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.732 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O3'-P-O5' 99.401 -2.42 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.732 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.873 0 O4'-C1'-N19 109.721 2.401 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.44 ' C6 ' H2'' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.42 -0.865 0 O3'-P-O5' 99.261 -2.494 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.889 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.074 0 N19-C1'-C2' 118.004 2.377 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.889 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-N19 109.453 2.066 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 109.422 2.028 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.596 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-N19 109.312 1.89 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.623 H2'' ' C8 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O3'-P-O5' 100.494 -1.845 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.623 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 101.312 -1.415 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.445 ' C5 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 116.225 1.266 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 tpt . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.151 -0.314 . . . . 9.4199999999999999 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -92.27 -9.81 40.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.804 0.335 . . . . 10.67 111.107 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 m -67.34 111.21 3.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.244 -0.435 . . . . 7.75 110.474 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m -93.51 -36.37 12.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.065 -0.516 . . . . 5.6600000000000001 111.329 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.53 105.93 2.95 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.832 -0.699 . . . . 3.5699999999999998 111.396 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.1 mt -106.09 112.94 41.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.912 0.387 . . . . 4.6799999999999997 111.327 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' B' ' 35' ' ' GLU . 7.3 p -87.92 129.84 38.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 120.86 0.362 . . . . 3.27 110.29 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -137.0 131.37 32.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.353 -0.385 . . . . 4.4500000000000002 110.835 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 tttm -65.96 134.42 52.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.104 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.32 -174.17 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.222 -0.444 . . . . 2.9399999999999999 110.035 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD2' ' HB2' ' A' ' 13' ' ' LEU . 12.4 p-10 -98.25 171.98 7.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.947 -0.39 . . . . 4.4400000000000004 109.947 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.693 ' HA ' ' O ' ' B' ' 30' ' ' GLU . 2.0 pm0 -78.7 23.58 0.32 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.638 0.256 . . . . 3.6099999999999999 111.631 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.55 HD22 HH12 ' A' ' 15' ' ' ARG . 6.8 mp -125.96 -37.41 2.28 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.617 -0.265 . . . . 4.3499999999999996 111.047 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA3' ' CZ ' ' B' ' 23' ' ' ARG . . . 115.01 44.43 0.68 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.642 -0.789 . . . . 2.0899999999999999 113.795 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.55 HH12 HD22 ' A' ' 13' ' ' LEU . 2.6 ptp85 -124.18 153.08 42.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.053 0.454 . . . . 3.6099999999999999 111.155 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -136.88 158.14 36.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.828 -0.624 . . . . 2.3300000000000001 110.254 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.519 HG21 ' H71' ' F' ' 16' ' ' ' DT' . 45.9 t -141.47 138.19 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.31 -0.404 . . . . 2.4100000000000001 110.182 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.31 145.31 30.04 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 109.982 -0.377 . . . . 3.1499999999999999 109.982 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.513 ' O ' ' HG3' ' A' ' 23' ' ' ARG . 48.9 Cg_exo -55.11 132.71 53.9 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.678 2.252 . . . . 2.71 112.695 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.42 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 14.6 tt -75.97 -29.01 19.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.053 0.454 . . . . 3.73 109.83 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -64.02 -35.98 82.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.508 -0.769 . . . . 4.3099999999999996 109.087 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 tp -68.24 -41.2 81.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.456 -0.793 . . . . 3.5800000000000001 109.195 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 19' ' ' PRO . 12.5 mtt180 -59.87 -43.85 94.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.795 -0.639 . . . . 2.9500000000000002 110.048 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.61 -23.16 65.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.704 -0.68 . . . . 3.8700000000000001 111.235 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 m -88.04 -28.76 21.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.934 0.397 . . . . 4.0899999999999999 110.528 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mp -75.21 -19.34 59.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.923 -0.581 . . . . 4.4900000000000002 110.386 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.83 33.81 23.37 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.042 -0.599 . . . . 3.7400000000000002 111.838 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 42.1 pt -119.3 168.51 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.289 . . . . 4.1100000000000003 110.692 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.51 -178.29 3.97 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.964 0.412 . . . . 4.9900000000000002 111.157 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.414 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.8 28.11 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.922 -0.581 . . . . 6.1699999999999999 110.932 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -130.16 32.88 4.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.474 0.654 . . . . 4.1200000000000001 109.6 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -96.43 -178.35 4.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.194 -0.912 . . . . 3.98 110.321 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -121.61 104.81 9.9 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.373 -0.376 . . . . 2.9500000000000002 110.249 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' HG22 ' B' ' 10' ' ' VAL . 95.5 mt -90.35 111.16 22.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.054 -0.521 . . . . 2.9500000000000002 111.251 -179.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' B' ' 7' ' ' VAL . 32.6 mt-10 -89.34 97.41 11.18 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.011 -0.737 . . . . 3.5099999999999998 109.011 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.466 ' HB ' HG23 ' B' ' 6' ' ' ILE . 5.9 mt -77.04 91.53 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.654 -0.703 . . . . 2.75 110.322 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -85.14 120.32 26.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.976 -0.556 . . . . 6.1299999999999999 111.155 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -111.42 96.29 4.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.575 -0.528 . . . . 3.1800000000000002 109.575 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.28 155.94 45.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.93 0.395 . . . . 3.6800000000000002 111.826 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 -90.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.225 -0.898 . . . . 4.2800000000000002 111.979 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -155.87 25.07 0.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.04 0.448 . . . . 3.1699999999999999 110.704 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' NZ ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -151.09 163.37 38.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.084 -0.507 . . . . 2.9100000000000001 110.722 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 11.7 mt -110.38 111.89 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.119 -0.492 . . . . 2.2599999999999998 110.42 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 ' NZ ' ' A' ' 42' ' ' LYS . 19.7 mt -88.28 98.16 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.315 -0.402 . . . . 3.1000000000000001 110.765 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.407 HD11 ' HB3' ' A' ' 34' ' ' LEU . 18.9 tp -84.13 85.7 7.31 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.253 -0.647 . . . . 2.4399999999999999 109.253 178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -103.24 167.04 10.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.249 -0.432 . . . . 5.3899999999999997 111.148 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.8 pttp -163.56 177.42 8.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.079 -0.51 . . . . 4.1399999999999997 109.884 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.7 p90 -93.77 175.89 6.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.555 -0.293 . . . . 5.4199999999999999 110.319 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -99.22 111.32 60.79 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.771 0.319 . . . . 4.54 111.016 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -83.9 -8.35 10.12 Favored 'Trans proline' 0 N--CA 1.462 -0.373 0 C-N-CA 122.949 2.433 . . . . 5.0199999999999996 111.574 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -98.18 127.27 44.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.442 -0.799 . . . . 6.6799999999999997 109.69 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 28.3 ttt -157.56 102.8 1.9 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.307 -0.406 . . . . 6.4699999999999998 109.997 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 p 57.02 -164.62 0.16 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.329 0.652 . . . . 5.7699999999999996 111.287 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.2 m -115.72 12.8 16.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.339 0.59 . . . . 4.5499999999999998 109.997 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 C--O 1.237 0.403 0 CA-C-N 115.689 -0.687 . . . . 6.7999999999999998 110.334 -179.939 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.182 0.515 . . . . 10.279999999999999 110.225 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -95.93 61.27 2.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.671 -0.695 . . . . 9.0299999999999994 110.088 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.49 101.13 0.56 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.713 -0.676 . . . . 6.5800000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.1 57.34 1.75 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 5.3399999999999999 110.992 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.45 159.68 28.16 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.711 -0.757 . . . . 4.1100000000000003 112.122 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.466 HG23 ' HB ' ' A' ' 36' ' ' ILE . 1.1 tp -112.51 116.72 53.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.044 0.449 . . . . 4.25 110.204 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.552 HG22 ' HG2' ' A' ' 35' ' ' GLU . 17.1 t -81.45 104.69 10.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.659 -0.7 . . . . 3.3199999999999998 109.929 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -115.51 141.64 47.78 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.778 -0.647 . . . . 4.4699999999999998 110.654 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.81 150.65 48.34 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.102 -0.499 . . . . 3.3999999999999999 109.972 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.421 HG22 ' HG ' ' A' ' 34' ' ' LEU . 49.0 t -68.83 132.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.018 0.437 . . . . 3.48 110.093 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -65.72 148.71 51.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.901 -0.591 . . . . 4.5199999999999996 109.744 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -58.57 -31.02 67.6 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.305 0.378 . . . . 4.8899999999999997 111.144 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 30.5 mt -118.75 -43.08 2.69 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 3.8199999999999998 110.577 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . 0.475 ' O ' ' HD3' ' B' ' 15' ' ' ARG . . . 136.81 92.99 0.33 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.782 -0.723 . . . . 2.7000000000000002 111.863 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.475 ' HD3' ' O ' ' B' ' 14' ' ' GLY . 0.7 OUTLIER -150.46 88.3 1.49 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.262 0.225 . . . . 3.7799999999999998 110.586 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 p -116.71 128.39 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.585 -0.446 . . . . 3.0 109.829 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.451 HG12 ' HB3' ' A' ' 15' ' ' ARG . 8.1 m -113.23 160.85 12.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.121 0.486 . . . . 2.9100000000000001 111.618 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 43' ' ' ILE . 16.9 pt -119.02 143.14 33.29 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.503 -0.772 . . . . 2.4399999999999999 110.048 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.24 129.97 33.59 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 123.207 2.605 . . . . 2.5699999999999998 112.557 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.439 ' HB ' ' NH2' ' B' ' 24' ' ' ARG . 0.3 OUTLIER -53.69 -53.46 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 113.058 0.762 . . . . 4.2800000000000002 113.058 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -58.47 -54.17 50.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.919 0.341 . . . . 4.7400000000000002 111.919 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -62.21 -37.86 86.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.571 0.224 . . . . 3.6499999999999999 111.028 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.493 ' CZ ' ' HA3' ' A' ' 14' ' ' GLY . 13.0 ttm180 -58.27 -56.51 21.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 3.98 111.172 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.439 ' NH2' ' HB ' ' B' ' 20' ' ' ILE . 38.8 mtm-85 -64.55 -35.95 82.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.695 -0.684 . . . . 4.7999999999999998 111.249 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 57.1 m -68.62 -28.34 66.82 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.872 0.368 . . . . 4.4100000000000001 110.62 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.01 -8.21 58.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 4.8499999999999996 111.123 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.25 13.72 41.18 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 3.6899999999999999 112.318 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 13.7 mt -103.5 117.45 48.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.797 0.332 . . . . 4.0099999999999998 110.19 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.63 174.5 7.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.293 -0.412 . . . . 4.4299999999999997 110.359 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 4.5 mp0 -79.14 12.8 2.1 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.391 0.615 . . . . 5.5599999999999996 110.989 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.77 24.02 1.89 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.083 0.468 . . . . 4.4699999999999998 110.227 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.81 -163.22 1.02 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.063 -0.517 . . . . 3.96 110.997 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.14 140.87 36.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.528 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -103.54 139.9 38.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.191 -0.459 . . . . 2.3999999999999999 110.302 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' B' ' 45' ' ' LEU . 6.6 tt0 -102.04 109.12 20.76 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.902 -0.59 . . . . 3.0 110.216 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.423 HG22 ' HG ' ' B' ' 45' ' ' LEU . 10.2 pt -85.72 102.83 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.444 0.64 . . . . 2.5 110.184 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -104.17 98.86 8.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.288 -0.869 . . . . 4.3899999999999997 109.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 p -74.81 115.63 16.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.444 0.64 . . . . 3.6000000000000001 110.883 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.428 ' O ' ' HD3' ' B' ' 42' ' ' LYS . 20.6 t70 -129.82 121.76 27.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.833 -0.621 . . . . 4.7400000000000002 110.544 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 33.0 t70 58.66 -95.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 5.3799999999999999 111.504 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -128.34 19.34 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.608 0.242 . . . . 3.7599999999999998 111.414 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -141.85 146.79 36.24 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.475 -0.49 . . . . 4.3499999999999996 110.977 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 44.8 mt -104.18 107.15 21.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 108.991 -0.744 . . . . 2.4199999999999999 108.991 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 7.3 mt -84.8 110.02 18.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 116.049 -0.523 . . . . 2.6899999999999999 110.788 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.507 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 5.1 mp -87.45 102.73 14.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.144 -0.687 . . . . 2.3599999999999999 109.144 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 163.93 12.86 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.101 -0.5 . . . . 3.21 110.866 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.433 ' H ' ' HG2' ' B' ' 47' ' ' LYS . 33.2 pttt -67.78 -41.43 83.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.597 -0.729 . . . . 3.6600000000000001 110.356 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 31.9 p90 176.04 165.04 0.39 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.528 -0.76 . . . . 5.2000000000000002 109.64 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.75 151.15 34.83 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 108.906 -0.775 . . . . 5.0999999999999996 108.906 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -60.51 -53.71 2.64 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.203 1.935 . . . . 3.8100000000000001 111.869 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 t30 50.13 54.72 10.6 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.488 0.492 . . . . 5.2000000000000002 110.435 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 6.6 mmt -79.92 57.03 2.49 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.923 -0.58 . . . . 6.1900000000000004 110.881 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -38.49 74.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.767 -0.652 . . . . 5.4199999999999999 111.12 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -161.95 74.5 0.44 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.026 -0.534 . . . . 5.5199999999999996 110.78 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.162 -0.472 . . . . 6.3799999999999999 110.666 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 121.16 0.505 . . . . 7.7999999999999998 110.408 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -110.06 111.16 22.35 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.909 -0.587 . . . . 8.5700000000000003 110.787 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 45.7 m -90.57 9.77 28.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.585 -0.734 . . . . 5.0099999999999998 110.921 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.28 63.39 2.49 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.179 0.514 . . . . 4.25 110.233 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.26 160.35 31.37 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 111.242 -0.743 . . . . 2.4700000000000002 111.242 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 16.3 mt -89.44 82.68 2.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.048 -0.723 . . . . 3.96 109.048 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -76.15 114.52 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.033 -0.985 . . . . 2.5299999999999998 111.489 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.01 152.44 33.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.535 -0.757 . . . . 3.6000000000000001 109.625 179.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -88.55 140.97 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.557 -0.292 . . . . 2.6400000000000001 111.342 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.9 t -78.75 130.28 36.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.09 -0.708 . . . . 2.7000000000000002 109.09 178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -106.4 -171.28 1.87 Allowed 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 121.195 -0.202 . . . . 3.5699999999999998 110.834 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -76.62 -2.02 30.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.305 0.574 . . . . 3.21 110.413 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.582 HD21 HH11 ' D' ' 15' ' ' ARG . 0.0 OUTLIER -62.8 -30.89 71.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.546 -0.752 . . . . 3.3900000000000001 111.09 179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.19 12.8 79.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.413 -1.075 . . . . 3.1600000000000001 110.413 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.617 ' HB3' ' O ' ' D' ' 16' ' ' VAL . 66.3 mtt180 -127.6 179.09 5.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.643 -0.778 . . . . 5.0499999999999998 109.499 -179.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.05 157.49 28.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.755 -0.831 . . . . 2.6400000000000001 108.755 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.0 153.86 16.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.664 0.269 . . . . 3.4399999999999999 110.968 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 pt -94.07 148.53 35.34 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 109.52 -0.548 . . . . 3.3399999999999999 109.52 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.57 129.6 35.97 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.29 1.993 . . . . 2.6600000000000001 111.829 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . 0.539 ' HA ' ' OP1' ' F' ' 5' ' ' ' DT' . 11.6 tt -52.69 -32.93 17.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.152 -0.477 . . . . 4.46 111.03 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -59.63 -39.38 84.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.79 -0.641 . . . . 4.1799999999999997 111.324 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' C' ' 22' ' ' LEU . 3.4 mm? -71.49 -47.43 55.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.398 -0.365 . . . . 3.5299999999999998 111.433 -178.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.524 ' NH1' ' HA3' ' D' ' 14' ' ' GLY . 43.9 ttt180 -69.04 -30.06 68.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 4.2199999999999998 111.437 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -76.36 -33.84 58.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.73 0.3 . . . . 5.04 111.418 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 13.3 m -84.86 -42.59 14.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.77 0.319 . . . . 4.29 111.579 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 95.7 mt -101.04 -81.17 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.051 0.453 . . . . 5.0199999999999996 110.99 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.74 148.23 8.37 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 4.0800000000000001 111.578 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.6 pt -131.34 158.79 43.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.859 0.361 . . . . 4.4699999999999998 111.0 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.51 155.61 16.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.309 -0.626 . . . . 3.6899999999999999 109.309 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -5.6 58.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 5.5800000000000001 111.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -116.66 15.93 15.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.123 0.487 . . . . 5.1399999999999997 110.233 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.03 177.76 8.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 2.8199999999999998 110.669 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' D' ' 7' ' ' VAL . . . -145.46 139.21 26.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.176 -0.465 . . . . 2.2599999999999998 110.554 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -112.35 128.86 56.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.914 -0.584 . . . . 2.6600000000000001 110.42 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 18.6 tt0 -78.59 106.76 10.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.64 -0.504 . . . . 2.25 109.64 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 50.9 mt -90.34 116.43 31.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 116.014 -0.539 . . . . 2.2400000000000002 110.915 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -126.69 128.13 46.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.203 -0.908 . . . . 2.3999999999999999 109.563 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 15.6 m -104.48 132.06 51.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.07 0.462 . . . . 2.5499999999999998 111.633 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' C' ' 42' ' ' LYS . 38.1 t70 -122.38 80.59 1.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.319 -0.622 . . . . 2.29 109.319 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 28.5 t70 68.9 -93.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.262 -0.881 . . . . 3.0 111.336 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -114.59 -6.94 12.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.767 0.317 . . . . 3.1400000000000001 111.267 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' C' ' 39' ' ' ASP . 7.2 ptpp? -107.85 136.95 46.71 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.887 -0.782 . . . . 2.96 108.887 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . 0.468 ' HB ' ' HB3' ' D' ' 45' ' ' LEU . 20.9 mt -113.22 141.75 27.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.036 0.446 . . . . 2.3199999999999998 111.752 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -121.22 119.26 58.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.49 -0.777 . . . . 2.27 110.074 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 5.3 mp -112.85 106.94 15.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.247 -0.433 . . . . 2.4399999999999999 110.058 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? -96.84 -176.68 3.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.652 -0.249 . . . . 3.02 110.409 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.7 -111.74 0.07 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.689 0.281 . . . . 2.96 110.553 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 52.2 p90 -82.42 149.9 27.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.685 0.278 . . . . 4.2000000000000002 110.407 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -123.89 119.85 26.7 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.38 -0.373 . . . . 3.2400000000000002 110.678 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -79.91 60.44 7.83 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.73 2.287 . . . . 3.5 111.796 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -128.54 119.59 25.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.82 -0.627 . . . . 3.7200000000000002 110.227 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.6 175.49 8.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.457 -0.338 . . . . 6.0099999999999998 110.121 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 4.9 m -69.22 143.51 53.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.533 -0.303 . . . . 5.6200000000000001 110.405 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.68 99.75 0.63 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.312 0.577 . . . . 4.1200000000000001 110.216 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 115.973 -0.558 . . . . 5.3099999999999996 110.028 -179.374 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 N-CA-C 110.382 -0.229 . . . . 3.6899999999999999 110.382 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -116.23 -172.7 2.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.283 -0.417 . . . . 3.5699999999999998 110.116 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.41 ' OG ' ' HG ' ' D' ' 22' ' ' LEU . 1.4 m -104.08 15.86 27.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.242 -0.435 . . . . 2.6400000000000001 111.63 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.1 42.42 1.03 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.926 0.393 . . . . 2.4399999999999999 111.051 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.28 60.41 3.29 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 111.202 -0.759 . . . . 1.9199999999999999 111.202 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 96.7 mt -126.91 137.8 56.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.728 0.299 . . . . 2.4500000000000002 110.872 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' HB1' ' C' ' 33' ' ' ALA . 13.6 m -75.61 124.11 32.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 2.6099999999999999 111.581 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.74 134.26 54.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.622 -0.717 . . . . 2.77 109.189 179.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -59.58 138.15 57.8 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.284 0.365 . . . . 3.1499999999999999 111.031 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . . . . . . . . . 30.5 m -81.8 175.69 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.015 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.544 ' OD2' ' HB2' ' D' ' 13' ' ' LEU . 21.5 t70 -100.64 151.81 21.18 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.437 -0.347 . . . . 4.5899999999999999 111.245 -179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -59.27 -30.75 68.52 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.913 -0.585 . . . . 6.0599999999999996 112.501 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.544 ' HB2' ' OD2' ' D' ' 11' ' ' ASP . 3.6 mm? -82.86 -1.85 53.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.21 0.529 . . . . 4.8399999999999999 110.571 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . 0.524 ' HA3' ' NH1' ' C' ' 23' ' ' ARG . . . 88.04 17.26 58.07 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.911 -0.662 . . . . 3.4300000000000002 111.91 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.582 HH11 HD21 ' C' ' 13' ' ' LEU . 86.1 mtm180 -87.94 141.14 28.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.809 -0.441 . . . . 4.5099999999999998 109.809 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.617 ' O ' ' HB3' ' C' ' 15' ' ' ARG . 86.3 t -87.14 109.83 19.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 2.75 110.326 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.492 HG13 ' NE ' ' C' ' 15' ' ' ARG . 1.4 t -89.68 108.89 19.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.619 -0.719 . . . . 3.3599999999999999 110.895 -179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.7 pt -100.13 158.19 32.46 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.696 -0.684 . . . . 3.0800000000000001 109.612 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.4 137.92 83.02 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.603 2.202 . . . . 3.46 112.045 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 22.0 pt -61.1 -31.86 51.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 4.8200000000000003 111.328 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -64.9 -34.01 77.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 4.9800000000000004 110.34 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.41 ' HG ' ' OG ' ' D' ' 3' ' ' SER . 0.5 OUTLIER -61.85 -46.26 90.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 3.25 110.565 -179.732 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' D' ' 28' ' ' ILE . 0.8 OUTLIER -61.87 -41.08 97.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.437 -0.347 . . . . 2.8799999999999999 110.891 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -68.02 -40.15 82.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 6.0999999999999996 111.119 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 11.8 m -75.2 -32.1 61.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.239 -0.437 . . . . 3.73 111.528 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.74 -22.04 64.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.384 -0.371 . . . . 2.9700000000000002 111.24 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.35 40.27 91.76 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.799 -0.715 . . . . 2.79 111.72 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . 0.505 ' O ' ' HD3' ' D' ' 23' ' ' ARG . 28.1 pt -112.48 128.46 69.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.146 0.498 . . . . 2.1499999999999999 110.243 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . 0.439 ' C ' ' H ' ' D' ' 31' ' ' LYS . . . -90.53 170.54 10.1 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.969 -0.559 . . . . 2.46 110.509 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -73.97 15.67 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.822 -0.626 . . . . 3.3999999999999999 110.811 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' D' ' 29' ' ' ALA . 7.3 mmtm -130.96 10.88 5.06 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.142 -0.688 . . . . 3.4399999999999999 109.142 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -93.12 -178.94 4.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.632 -0.713 . . . . 2.6600000000000001 110.9 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' D' ' 48' ' ' TYR . . . -131.55 152.96 50.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.186 -0.461 . . . . 2.2999999999999998 110.523 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.478 ' HB3' HD11 ' D' ' 45' ' ' LEU . 96.1 mt -131.87 141.35 49.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1099999999999999 110.261 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -95.35 109.95 22.03 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.68 -0.489 . . . . 2.3399999999999999 109.68 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mt -99.06 147.46 7.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.019 -0.537 . . . . 2.3300000000000001 110.893 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -159.24 169.88 23.13 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.151 -0.685 . . . . 2.2400000000000002 109.151 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 141.06 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.934 0.397 . . . . 2.1400000000000001 110.69 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.63 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.4 t70 -131.66 107.56 8.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.894 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t70 64.85 -87.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.42 0.45 . . . . 2.7599999999999998 111.107 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -136.09 12.04 3.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.898 0.38 . . . . 2.3500000000000001 110.484 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 30.7 pttt -123.21 155.11 37.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.041 0.448 . . . . 2.3399999999999999 111.152 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.76 129.35 45.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.827 -0.624 . . . . 1.99 110.519 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 45.2 mm -104.09 123.26 57.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.017 -0.538 . . . . 2.0 109.671 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' D' ' 34' ' ' LEU . 63.8 tp -113.62 114.71 26.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.202 0.525 . . . . 2.77 110.051 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -111.11 150.27 29.65 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.662 -0.699 . . . . 2.3599999999999999 109.61 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -75.17 163.29 27.69 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.9 -0.32 . . . . 2.9900000000000002 110.183 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' D' ' 33' ' ' ALA . 43.2 p90 -59.95 166.78 2.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.078 -0.51 . . . . 3.2599999999999998 110.909 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -66.74 115.35 23.79 Favored Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 108.968 -0.752 . . . . 5.0300000000000002 108.968 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.13 -76.07 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.482 2.121 . . . . 3.73 112.679 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 52.72 32.28 11.79 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.304 0.574 . . . . 4.6200000000000001 110.2 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 53.9 mtt -104.05 98.39 8.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.567 -0.742 . . . . 5.29 110.849 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -15.84 60.64 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.772 -0.649 . . . . 5.8300000000000001 110.371 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t 69.25 132.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.473 -0.785 . . . . 4.5199999999999996 111.199 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.496 -0.764 . . . . 7.0 110.041 -179.055 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.686 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 106.992 0.811 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.731 H2'' ' N7 ' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 N19-C1'-C2' 116.915 1.697 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.731 ' N7 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.867 0 O4'-C1'-N19 109.347 1.934 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.701 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-N19 109.207 1.758 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.737 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 109.173 1.716 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.737 ' C5 ' H2'' ' E' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 117.319 1.949 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.59 ' C8 ' " H1'" ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O4'-C1'-N19 109.328 1.91 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.539 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-N19 109.597 2.246 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.69 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.61 0 O3'-P-O5' 99.877 -2.17 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.69 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C1'-N19 109.201 1.752 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.573 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 O4'-C1'-N19 109.574 2.218 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.573 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.77 0 O4'-C1'-N19 109.656 2.32 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.576 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.664 0 O3'-P-O5' 99.566 -2.334 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.576 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.688 0 O4'-C1'-N19 109.685 2.356 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.546 " C2'" ' H72' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.777 0 O4'-C1'-N19 109.72 2.4 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.546 ' H72' " C2'" ' E' ' 15' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.738 0 O4'-C1'-N19 109.555 2.193 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.47 ' C8 ' " H1'" ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-N19 109.913 2.641 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.517 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.695 0 O4'-C1'-N19 109.675 2.344 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 P--O3' 1.599 -0.68 0 O4'-C1'-N19 109.673 2.341 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.584 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.728 0 O3'-P-O5' 100.029 -2.09 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.584 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C1'-N19 109.595 2.244 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.431 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O3'-P-O5' 99.821 -2.2 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.567 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.422 -0.663 0 O4'-C1'-N19 109.761 2.451 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.775 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.765 0 O3'-P-O5' 100.486 -1.849 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.775 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.776 0 N19-C1'-C2' 116.087 1.18 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.708 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.595 0 O4'-C1'-N19 108.67 1.088 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.666 0 N19-C1'-C2' 116.844 1.652 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.629 ' C8 ' H2'' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 O4'-C1'-N19 110.252 3.065 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.457 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-N19 109.943 2.679 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.539 ' OP1' ' HA ' ' C' ' 20' ' ' ILE . . . . . . . . 0 O5'--C5' 1.431 -0.531 0 O3'-P-O5' 99.867 -2.175 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.806 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-N19 109.716 2.395 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.806 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O3'-P-O5' 99.894 -2.161 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.48 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O3'-P-O5' 100.05 -2.079 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.466 ' C5 ' H2'' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.841 2.551 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.554 " H1'" ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O3'-P-O5' 99.548 -2.343 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.554 ' C8 ' " H1'" ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 O4'-C1'-N19 109.684 2.355 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.52 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-N19 109.706 2.382 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.765 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 O3'-P-O5' 99.933 -2.141 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.765 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.984 2.73 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.501 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O3'-P-O5' 99.417 -2.412 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.572 H2'' ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.597 -0.825 0 O3'-P-O5' 99.687 -2.27 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.572 ' C8 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.42 -0.824 0 O4'-C1'-N19 109.676 2.345 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.566 H2'' ' C5 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.421 -0.766 0 O3'-P-O5' 99.164 -2.545 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.566 ' C5 ' H2'' ' F' ' 18' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.757 0 O3'-P-O5' 99.016 -2.623 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.855 H2'' ' N7 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 100.022 -2.094 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.855 ' N7 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.176 0 O4'-C1'-N19 109.949 2.687 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.488 H2'' ' C6 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O3'-P-O5' 100.404 -1.893 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.883 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.528 0.529 0 N19-C1'-C2' 117.389 1.993 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.883 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 104.432 -1.168 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.511 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 116.561 1.476 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 110.14 -0.318 . . . . 9.4199999999999999 110.14 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -99.46 104.8 16.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.228 0.537 . . . . 10.67 111.249 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 m -112.99 148.31 35.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.471 -0.786 . . . . 7.75 109.036 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.04 -97.2 0.13 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.913 0.338 . . . . 5.6600000000000001 111.913 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -125.97 118.79 3.26 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.597 -0.811 . . . . 3.5699999999999998 112.362 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.0 mm -98.08 112.15 29.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.788 0.328 . . . . 4.6799999999999997 110.263 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' B' ' 34' ' ' LEU . 3.0 t -81.73 105.63 11.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.842 -0.429 . . . . 3.27 109.842 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -125.88 155.45 41.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.197 -0.456 . . . . 4.4500000000000002 111.248 -178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -70.41 142.42 52.04 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.886 -0.597 . . . . 2.8900000000000001 110.951 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.409 HG22 ' O ' ' B' ' 32' ' ' ASP . 19.6 m -107.62 -169.14 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.689 -0.486 . . . . 2.9399999999999999 109.689 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.92 151.37 46.63 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.636 -0.505 . . . . 4.4400000000000004 109.636 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.89 -16.52 63.78 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 112.002 0.371 . . . . 3.6099999999999999 112.002 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' CD1' ' H71' ' F' ' 18' ' ' ' DT' . 6.7 mp -123.22 26.71 7.87 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.743 -0.383 . . . . 4.3499999999999996 111.499 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.13 94.46 0.45 Allowed Glycine 0 CA--C 1.52 0.4 0 N-CA-C 114.973 0.749 . . . . 2.0899999999999999 114.973 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' HG3' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -178.75 157.17 0.91 Allowed 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.047 -0.723 . . . . 3.6099999999999999 109.047 178.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.603 HG13 ' HB ' ' B' ' 16' ' ' VAL . 7.0 p -133.46 135.3 56.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.454 0.645 . . . . 2.3300000000000001 111.304 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.65 134.92 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.441 -0.799 . . . . 2.4100000000000001 110.025 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.4 mt -86.41 127.07 62.47 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.367 -0.379 . . . . 3.1499999999999999 110.799 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.75 146.92 49.53 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 122.48 2.12 . . . . 2.71 111.728 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.32 -35.05 69.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 3.73 110.964 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.03 -47.69 85.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.967 -0.561 . . . . 4.3099999999999996 110.586 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.1 tp -70.45 -39.09 74.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 3.5800000000000001 110.288 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -59.88 -49.19 78.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.063 -0.517 . . . . 2.9500000000000002 111.066 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -69.78 -22.98 63.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.629 -0.26 . . . . 3.8700000000000001 111.361 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.5 m -75.39 -34.5 61.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.177 0.513 . . . . 4.0899999999999999 110.107 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.8 mp -84.5 -36.43 22.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.947 -0.57 . . . . 4.4900000000000002 110.574 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.12 34.36 30.11 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.739 -0.743 . . . . 3.7400000000000002 111.589 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.7 pt -93.53 -171.82 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.895 0.379 . . . . 4.1100000000000003 110.86 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 167.87 19.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.945 -0.571 . . . . 4.9900000000000002 111.392 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.3 -61.65 0.86 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.324 0.583 . . . . 6.1699999999999999 110.571 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' B' ' 10' ' ' VAL . 57.8 mttp -93.09 77.08 4.66 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.83 -0.623 . . . . 4.1200000000000001 110.208 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -144.4 -172.32 3.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.984 -0.553 . . . . 3.98 110.914 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -109.18 136.73 48.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.761 0.315 . . . . 2.9500000000000002 110.79 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 mp -109.52 149.33 29.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 2.9500000000000002 111.204 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -105.99 100.75 10.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.716 -0.675 . . . . 3.5099999999999998 109.581 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.1 mt -81.62 113.67 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.175 -0.466 . . . . 2.75 111.949 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -127.14 113.12 15.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.81 -0.632 . . . . 6.1299999999999999 109.952 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -88.3 123.68 40.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 3.1800000000000002 111.38 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -125.78 107.19 10.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.661 . . . . 3.6800000000000002 110.161 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.1 t0 66.82 -85.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.563 0.539 . . . . 4.2800000000000002 111.005 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.512 ' OE2' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -142.94 22.13 1.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.558 0.694 . . . . 3.1699999999999999 109.349 178.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.512 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 18.9 mtmm -120.81 121.72 38.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.062 -0.972 . . . . 2.9100000000000001 110.039 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.437 ' HB ' ' HB3' ' B' ' 45' ' ' LEU . 20.6 mt -90.83 90.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.807 -0.812 . . . . 2.2599999999999998 108.807 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.433 HG22 ' HG3' ' A' ' 46' ' ' LYS . 18.9 mt -76.84 101.97 3.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.785 -0.643 . . . . 3.1000000000000001 111.33 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.1 mt -89.63 93.98 9.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.937 -0.574 . . . . 2.4399999999999999 109.65 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 44' ' ' ILE . 15.3 mtmt -96.14 -169.99 2.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.854 -0.612 . . . . 5.3899999999999997 109.872 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.5 pttp 175.81 -171.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.69 -0.485 . . . . 4.1399999999999997 109.69 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.58 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 2.4 p90 -83.72 -171.35 3.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.107 -0.701 . . . . 5.4199999999999999 109.107 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 45.0 mmtt -107.3 95.65 13.9 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-O 120.924 0.392 . . . . 4.54 110.899 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 2.9 Cg_exo -77.36 -41.47 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.266 2.644 . . . . 5.0199999999999996 113.144 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -71.06 102.23 2.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.091 0.472 . . . . 6.6799999999999997 110.968 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.45 0.63 16.6 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.005 -0.543 . . . . 6.4699999999999998 110.518 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.555 ' HB ' ' SG ' ' C' ' 54' ' ' CYS . 0.0 OUTLIER -77.38 -74.36 0.26 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.879 -0.601 . . . . 5.7699999999999996 110.356 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.2 m -86.58 95.95 9.93 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.845 -0.428 . . . . 4.5499999999999998 109.845 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.04 -0.527 . . . . 6.7999999999999998 110.381 -179.741 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 C--O 1.235 0.328 0 CA-C-O 120.572 0.225 . . . . 10.279999999999999 110.452 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.423 ' H ' ' HG2' ' B' ' 21' ' ' GLU . 5.6 ptpt -154.37 152.85 30.69 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.303 -0.408 . . . . 9.0299999999999994 110.143 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 7.3 m -121.48 15.65 11.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.13 0.491 . . . . 6.5800000000000001 110.143 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.28 -179.2 6.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.51 -0.768 . . . . 5.3399999999999999 110.926 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.85 126.69 17.96 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.683 -0.77 . . . . 4.1100000000000003 111.272 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.18 110.92 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 120.894 0.378 . . . . 4.25 110.607 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -87.28 73.37 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.281 0.562 . . . . 3.3199999999999998 110.69 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.6 116.36 6.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.534 -0.757 . . . . 4.4699999999999998 110.745 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 pttp -90.84 155.14 18.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 3.3999999999999999 110.856 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.424 HG21 ' HA ' ' A' ' 31' ' ' LYS . 9.3 p -71.36 148.33 10.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.542 -0.54 . . . . 3.48 109.542 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -131.39 -168.72 2.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.359 -0.382 . . . . 4.5199999999999996 110.55 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -78.12 48.11 0.71 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.276 0.56 . . . . 4.8899999999999997 109.889 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.41 HD11 ' H62' ' E' ' 10' ' ' ' DA' . 18.9 tp -165.17 -45.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.526 -0.761 . . . . 3.8199999999999998 109.802 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.31 95.76 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.789 -0.641 . . . . 2.7000000000000002 112.202 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -163.63 145.96 9.66 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 122.744 -0.268 . . . . 3.7799999999999998 110.762 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' HG13 ' A' ' 16' ' ' VAL . 11.0 t -112.96 145.23 19.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.924 -0.769 . . . . 3.0 108.924 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 15' ' ' ARG . 11.9 p -132.56 154.2 39.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.088 0.47 . . . . 2.9100000000000001 111.531 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.44 HG23 ' HD2' ' B' ' 19' ' ' PRO . 58.4 mt -70.82 140.74 86.56 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.268 -0.878 . . . . 2.4399999999999999 109.172 178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.44 ' HD2' HG23 ' B' ' 18' ' ' ILE . 57.8 Cg_exo -35.98 120.64 0.22 Allowed 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.528 2.818 . . . . 2.5699999999999998 113.109 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 38.2 mt -50.66 -59.51 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 4.2800000000000002 112.625 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' B' ' 2' ' ' LYS . 29.5 mp0 -57.96 -39.78 78.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 4.7400000000000002 111.872 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 14.8 tp -58.46 -38.56 77.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.027 0.441 . . . . 3.6499999999999999 111.399 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.403 ' HA ' ' HA2' ' B' ' 27' ' ' GLY . 9.9 mmm180 -86.49 -33.83 20.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 3.98 111.146 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -63.81 -36.59 84.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.355 -0.384 . . . . 4.7999999999999998 111.043 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 19.6 p -92.01 -60.79 1.77 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.539 -0.301 . . . . 4.4100000000000001 111.701 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 35.5 mt -86.73 -66.93 0.85 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.987 0.366 . . . . 4.8499999999999996 111.987 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' B' ' 23' ' ' ARG . . . 91.27 82.64 1.43 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.345 -0.931 . . . . 3.6899999999999999 111.268 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . 0.414 HD11 HG21 ' B' ' 18' ' ' ILE . 24.4 pt -79.44 -162.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.454 0.169 . . . . 4.0099999999999998 111.406 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -47.15 139.51 5.94 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.787 0.679 . . . . 4.4299999999999997 112.104 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -133.85 -60.62 0.82 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.758 -0.655 . . . . 5.5599999999999996 111.19 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.42 89.89 3.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.4 -0.364 . . . . 4.4699999999999998 111.449 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.409 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.7 t0 -179.32 -176.82 0.42 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.97 0.414 . . . . 3.96 110.453 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.91 121.97 44.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.888 -0.596 . . . . 1.98 109.487 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 7' ' ' VAL . 8.8 mp -100.17 160.04 14.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.351 -0.386 . . . . 2.3999999999999999 111.174 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -93.79 110.83 22.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.294 0.569 . . . . 3.0 111.334 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 21.5 mt -87.59 95.15 4.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.489 -0.778 . . . . 2.5 109.8 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.462 ' HB3' ' HB ' ' B' ' 44' ' ' ILE . 30.2 t80 -91.17 104.37 16.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.079 0.466 . . . . 4.3899999999999997 109.821 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.74 122.06 37.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.308 0.575 . . . . 3.6000000000000001 110.723 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -118.48 97.08 5.57 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.884 -0.598 . . . . 4.7400000000000002 109.64 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 35.9 t70 64.66 -84.29 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.414 -0.812 . . . . 5.3799999999999999 110.488 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -133.73 10.09 3.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.82 0.343 . . . . 3.7599999999999998 110.419 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -106.59 142.04 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 4.3499999999999996 109.627 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 68.2 mt -106.44 104.32 16.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.856 0.36 . . . . 2.4199999999999999 110.309 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' B' ' 37' ' ' TYR . 86.6 mt -90.66 99.21 9.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.042 0.449 . . . . 2.6899999999999999 110.412 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' ILE . 5.0 tp -83.73 97.48 9.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.989 -0.55 . . . . 2.3599999999999999 109.787 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -89.78 154.87 19.58 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.136 -0.484 . . . . 3.21 110.352 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttm -56.7 169.44 0.48 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.275 0.56 . . . . 3.6600000000000001 111.652 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -65.69 142.62 57.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.808 -0.633 . . . . 5.2000000000000002 111.446 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -130.16 143.87 50.87 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.491 -0.777 . . . . 5.0999999999999996 109.603 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_exo -52.43 -63.07 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.49 2.127 . . . . 3.8100000000000001 111.807 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' B' ' 52' ' ' MET . 5.0 m-20 54.3 -158.56 0.18 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.083 -0.508 . . . . 5.2000000000000002 111.422 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . 0.443 ' H ' ' HB3' ' B' ' 51' ' ' ASN . 0.0 OUTLIER -148.42 127.41 12.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.289 -0.263 . . . . 6.1900000000000004 110.289 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.21 153.96 39.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.841 0.353 . . . . 5.4199999999999999 111.027 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.46 145.44 41.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 5.5199999999999996 110.875 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.557 -0.292 . . . . 6.3799999999999999 110.382 179.748 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 CA--C 1.517 -0.314 0 CA-C-O 120.795 0.331 . . . . 7.7999999999999998 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -67.22 143.02 56.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.763 -0.653 . . . . 8.5700000000000003 109.947 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . 0.512 ' HA ' HD11 ' C' ' 6' ' ' ILE . 4.2 m -130.08 39.14 3.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.414 0.626 . . . . 5.0099999999999998 110.038 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 78.32 8.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.183 -0.917 . . . . 4.25 111.849 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.9 82.63 0.78 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.822 -0.626 . . . . 2.4700000000000002 112.821 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' C' ' 3' ' ' SER . 15.3 mm -82.72 100.45 6.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.054 -0.35 . . . . 3.96 110.054 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 16.9 t -93.54 102.17 13.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.079 0.466 . . . . 2.5299999999999998 110.263 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -140.99 168.68 19.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.92 -0.582 . . . . 3.6000000000000001 110.789 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.16 135.04 48.74 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.776 -0.647 . . . . 2.6400000000000001 109.843 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -89.06 -161.33 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.161 -0.472 . . . . 2.7000000000000002 111.134 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -78.92 151.82 31.49 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.44 -0.578 . . . . 3.5699999999999998 109.44 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . 0.459 ' HB2' ' H73' ' F' ' 7' ' ' ' DT' . 0.0 OUTLIER -68.87 -31.45 70.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.335 . . . . 3.21 111.702 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' C' ' 13' ' ' LEU . 1.3 mm? -104.19 -39.88 6.35 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.073 -0.251 . . . . 3.3900000000000001 110.95 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.39 -9.51 1.93 Allowed Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.561 -0.828 . . . . 3.1600000000000001 112.963 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -79.13 79.3 5.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 5.0499999999999998 110.17 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -116.99 167.45 10.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.345 -0.389 . . . . 2.6400000000000001 110.616 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . 0.776 HG22 ' HA ' ' D' ' 15' ' ' ARG . 2.6 t -145.3 158.32 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.339 -0.615 . . . . 3.4399999999999999 109.339 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.46 ' H ' HD12 ' C' ' 18' ' ' ILE . 2.1 mp -59.84 134.58 89.75 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.602 -0.518 . . . . 3.3399999999999999 109.602 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -37.83 142.47 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.068 3.178 . . . . 2.6600000000000001 113.601 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . 0.444 ' H ' HD12 ' C' ' 20' ' ' ILE . 4.1 mp -51.16 -52.17 19.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.578 . . . . 4.46 111.421 -179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mp0 -59.92 -48.95 79.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.617 -0.72 . . . . 4.1799999999999997 111.87 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.62 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 24.5 tp -66.86 -47.22 72.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.316 . . . . 3.5299999999999998 111.716 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.435 HH12 H5'' ' F' ' 4' ' ' ' DG' . 10.9 ttm105 -60.48 -34.07 73.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.397 -0.365 . . . . 4.2199999999999998 110.818 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' C' ' 24' ' ' ARG . 38.4 ttp180 -61.65 -45.93 91.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.592 . . . . 5.04 110.772 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -22.18 62.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.151 -0.477 . . . . 4.29 111.316 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 78.9 mt -81.4 -49.41 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 5.0199999999999996 110.598 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.77 48.6 21.14 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.942 -0.647 . . . . 4.0800000000000001 112.25 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 6.9 pt -85.48 165.33 2.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.572 0.225 . . . . 4.4699999999999998 110.719 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.57 164.16 17.03 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.424 -0.353 . . . . 3.6899999999999999 110.398 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.94 -50.41 3.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.959 0.409 . . . . 5.5800000000000001 110.552 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . 0.496 ' HE3' ' OE2' ' D' ' 12' ' ' GLU . 32.6 mttp -80.89 62.66 4.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 5.1399999999999997 110.548 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -146.58 -154.27 0.54 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.987 -0.551 . . . . 2.8199999999999998 110.053 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . 0.543 ' HA ' HG23 ' D' ' 10' ' ' VAL . . . -138.65 166.17 25.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.665 0.269 . . . . 2.2599999999999998 110.899 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 37.7 mt -133.04 145.52 50.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.209 -0.45 . . . . 2.6600000000000001 110.333 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.689 ' O ' ' HA ' ' C' ' 45' ' ' LEU . 1.1 tt0 -96.25 134.86 38.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.56 -0.291 . . . . 2.25 110.403 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 10.8 mt -103.33 116.64 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.982 0.42 . . . . 2.2400000000000002 111.459 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -137.43 157.65 46.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.315 -0.857 . . . . 2.3999999999999999 108.861 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -127.68 150.96 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.357 0.599 . . . . 2.5499999999999998 112.517 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -138.33 87.49 2.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.764 -1.107 . . . . 2.29 108.507 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 68.19 -105.45 0.07 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.522 -0.763 . . . . 3.0 110.141 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' D' ' 47' ' ' LYS . 26.9 mm-40 -104.55 3.89 32.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 3.1400000000000001 110.728 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.04 149.3 29.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.804 0.335 . . . . 2.96 110.717 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' D' ' 44' ' ' ILE . 92.5 mt -111.89 133.32 57.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 109.139 -0.689 . . . . 2.3199999999999998 109.139 177.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 96.3 mt -112.69 112.41 40.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.402 -0.363 . . . . 2.27 110.619 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' C' ' 35' ' ' GLU . 56.4 mt -106.97 104.72 14.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 110.553 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.73 176.98 6.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 3.02 110.481 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -94.32 -52.3 4.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.052 0.453 . . . . 2.96 111.096 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -125.47 140.88 52.39 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.194 -0.457 . . . . 4.2000000000000002 111.27 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -167.34 121.31 0.8 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.652 -0.704 . . . . 3.2400000000000002 109.168 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.47 89.2 1.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.456 2.104 . . . . 3.5 113.061 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -152.71 72.15 0.96 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.2 0.524 . . . . 3.7200000000000002 110.203 178.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 26.4 ptm -150.94 21.97 0.77 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.787 -0.642 . . . . 6.0099999999999998 109.929 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.18 90.74 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.614 -0.721 . . . . 5.6200000000000001 110.56 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . 0.555 ' SG ' ' HB ' ' A' ' 53' ' ' THR . 8.4 t -83.32 70.18 10.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.395 -0.366 . . . . 4.1200000000000001 110.646 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 N--CA 1.465 0.32 0 CA-C-N 115.786 -0.643 . . . . 5.3099999999999996 110.098 179.334 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . 0.451 ' SD ' ' HG3' ' D' ' 8' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.97 0.414 . . . . 3.6899999999999999 110.817 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -77.36 163.73 26.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 3.5699999999999998 110.487 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -85.41 34.63 0.58 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.169 0.509 . . . . 2.6400000000000001 111.739 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.65 27.64 3.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.057 -0.519 . . . . 2.4399999999999999 110.445 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.15 45.23 6.69 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.894 -0.883 . . . . 1.9199999999999999 110.894 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 45.4 mt -112.0 135.03 52.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.919 0.39 . . . . 2.4500000000000002 111.046 -178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.569 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 8.5 t -87.03 142.61 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.024 -0.535 . . . . 2.6099999999999999 111.766 -178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.451 ' HG3' ' SD ' ' D' ' 1' ' ' MET . 0.6 OUTLIER -136.21 137.74 41.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 2.77 109.45 178.861 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . 0.414 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 1.6 tmmt? -63.03 139.99 58.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.32 -0.622 . . . . 3.1499999999999999 109.32 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' C' ' 33' ' ' ALA . 6.4 t -78.11 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.544 -0.462 . . . . 3.0800000000000001 110.395 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.602 ' HB3' ' H ' ' D' ' 15' ' ' ARG . 14.4 t70 -170.99 166.29 7.47 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.525 -0.546 . . . . 4.5899999999999999 109.525 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.496 ' OE2' ' HE3' ' C' ' 31' ' ' LYS . 22.5 tp10 -57.76 -37.38 73.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.804 0.335 . . . . 6.0599999999999996 111.211 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' D' ' 13' ' ' LEU . 2.6 mm? -110.82 12.89 22.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.753 0.311 . . . . 4.8399999999999999 111.479 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.24 75.14 0.98 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 3.4300000000000002 113.575 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.776 ' HA ' HG22 ' C' ' 17' ' ' VAL . 2.0 mpt_? -135.78 109.47 8.05 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.507 -0.923 . . . . 4.5099999999999998 108.507 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 4.8 p -84.25 106.58 14.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.7 0.762 . . . . 2.75 110.988 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.08 89.6 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 CA-C-N 115.26 -0.882 . . . . 3.3599999999999999 108.765 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 30.8 mt -54.35 117.84 14.46 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 3.0800000000000001 109.573 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -49.56 131.95 29.25 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.84 2.36 . . . . 3.46 113.076 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.57 HG21 " H3'" ' E' ' 16' ' ' ' DT' . 1.7 pp -65.2 -27.96 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-N 115.944 -0.571 . . . . 4.8200000000000003 110.522 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 51.1 mp0 -64.76 -30.5 71.51 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 108.479 -0.934 . . . . 4.9800000000000004 108.479 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.78 -37.55 62.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.111 -0.949 . . . . 3.25 109.126 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -60.38 -47.67 85.05 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.057 -0.52 . . . . 2.8799999999999999 110.323 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -64.58 -34.34 78.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.971 -0.559 . . . . 6.0999999999999996 110.726 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 86.6 m -72.17 -42.57 65.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.005 -0.543 . . . . 3.73 110.754 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 58.2 mt -67.26 -43.92 80.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.31 -0.405 . . . . 2.9700000000000002 110.682 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.0 31.85 1.98 Allowed Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.962 -0.637 . . . . 2.79 112.11 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 41.6 pt -123.52 165.73 19.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 110.137 -0.32 . . . . 2.1499999999999999 110.137 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.54 -106.77 0.35 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.656 0.243 . . . . 2.46 111.656 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' D' ' 31' ' ' LYS . 0.4 OUTLIER -108.23 -73.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.862 0.319 . . . . 3.3999999999999999 111.862 -178.509 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' D' ' 30' ' ' GLU . 35.5 mttp -78.56 67.52 4.34 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.01 0.433 . . . . 3.4399999999999999 111.01 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.03 159.1 24.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.619 -0.719 . . . . 2.6600000000000001 111.148 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -114.67 140.29 48.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.714 -0.675 . . . . 2.2999999999999998 110.41 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 74.7 mt -127.91 159.3 35.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.647 -0.251 . . . . 2.1099999999999999 110.607 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 60.6 tt0 -96.0 104.93 16.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.285 -0.416 . . . . 2.3399999999999999 110.002 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 47.4 mt -91.22 124.07 43.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.007 -0.542 . . . . 2.3300000000000001 111.159 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -139.95 179.77 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.321 -0.622 . . . . 2.2400000000000002 109.321 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 14.9 p -139.66 146.3 25.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.984 0.421 . . . . 2.1400000000000001 110.732 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 22.5 t70 -133.64 103.93 6.12 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.555 -0.535 . . . . 1.99 109.555 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 27.3 t70 67.01 -82.42 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.588 0.555 . . . . 2.7599999999999998 110.761 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -146.31 34.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.578 -0.283 . . . . 2.3500000000000001 110.916 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 0.9 OUTLIER -136.05 150.07 49.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.498 0.19 . . . . 2.3399999999999999 111.181 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' C' ' 45' ' ' LEU . 6.4 mt -82.9 119.45 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-N 116.376 -0.374 . . . . 1.99 110.521 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' C' ' 43' ' ' ILE . 49.4 mm -100.83 110.22 27.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.155 -0.475 . . . . 2.0 110.293 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tp -106.43 98.46 8.13 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.973 -0.558 . . . . 2.77 109.783 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.435 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 46.9 mtpt -91.77 125.56 36.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.09 0.472 . . . . 2.3599999999999999 111.073 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' C' ' 41' ' ' GLU . 12.7 ptmm? -77.62 146.4 36.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.763 -0.653 . . . . 2.9900000000000002 109.427 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -78.0 164.38 25.12 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.794 0.33 . . . . 3.2599999999999998 110.251 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -99.12 111.92 61.96 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.086 -0.709 . . . . 5.0300000000000002 109.086 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.26 -46.11 36.26 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.781 2.321 . . . . 3.73 112.725 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 t30 48.34 52.04 14.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.48 0.657 . . . . 4.6200000000000001 110.618 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 16.5 ptm -131.16 137.84 49.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.789 -0.642 . . . . 5.29 110.159 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.67 149.2 29.87 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.414 -0.357 . . . . 5.8300000000000001 110.578 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 13.8 t -74.49 74.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.496 0.665 . . . . 4.5199999999999996 109.955 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.13 -0.938 . . . . 7.0 109.564 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.678 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-N19 108.628 1.034 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.678 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 N19-C1'-C2' 117.058 1.786 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.692 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 O4'-C1'-N19 109.32 1.9 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.692 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.217 1.771 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.564 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O3'-P-O5' 100.636 -1.77 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.604 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O3'-P-O5' 100.478 -1.854 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.604 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C1'-N19 109.363 1.954 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.511 H2'' ' C6 ' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O3'-P-O5' 100.183 -2.009 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.741 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.669 0 O3'-P-O5' 99.775 -2.223 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.741 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 O4'-C1'-N19 109.489 2.111 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.478 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.476 2.094 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.566 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.647 0 O4'-C1'-N19 109.808 2.51 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.566 ' C6 ' H2'' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O4'-C1'-N19 109.498 2.122 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 109.668 2.335 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.465 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.705 0 O4'-C1'-N19 109.721 2.402 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.654 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.715 0 O3'-P-O5' 99.449 -2.395 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.654 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-N19 109.931 2.664 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.487 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.121 0 O4'-C1'-N19 109.643 2.303 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.574 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.8 0 O3'-P-O5' 100.587 -1.797 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.574 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 O4'-C1'-N19 109.475 2.094 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.644 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C1'-N19 109.382 1.977 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.644 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 110.157 2.946 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.676 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-N19 109.544 2.18 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.698 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 N19-C1'-C2' 116.714 1.571 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 N19-C1'-C2' 115.878 1.049 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.724 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C4'-C3' 104.846 -0.754 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.724 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 N19-C1'-C2' 116.947 1.717 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.622 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 110.167 2.958 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.535 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.954 0 O3'-P-O5' 99.852 -2.183 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.535 ' H72' " C2'" ' F' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.955 0 O4'-C1'-N19 109.992 2.74 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.56 " C2'" ' H72' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.65 0 O3'-P-O5' 98.925 -2.671 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.56 ' H72' " C2'" ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.781 0 O4'-C1'-N19 109.729 2.411 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.467 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 99.354 -2.445 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.691 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O3'-P-O5' 99.779 -2.221 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.691 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O3'-P-O5' 100.372 -1.909 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.495 ' C8 ' " H1'" ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.668 2.335 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.487 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.081 0 O3'-P-O5' 99.254 -2.498 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.718 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.67 0 O3'-P-O5' 99.507 -2.365 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.718 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.061 0 O4'-C1'-N19 109.83 2.538 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.598 ' H71' " C2'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.697 0 O3'-P-O5' 99.995 -2.108 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.721 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.596 -0.951 0 N19-C1'-C2' 118.018 2.386 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.721 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.431 0.814 0 O4'-C1'-N19 110.099 2.873 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.463 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O3'-P-O5' 99.483 -2.377 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.713 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.422 -0.662 0 O3'-P-O5' 99.311 -2.468 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.713 ' C8 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.758 0 O3'-P-O5' 100.183 -2.009 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.653 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.595 -0.977 0 O4'-C1'-N19 109.59 2.237 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.689 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O3'-P-O5' 100.474 -1.856 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.689 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 O3'-P-O5' 100.685 -1.745 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.684 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.652 0 O3'-P-O5' 101.431 -1.352 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.43 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.447 1.404 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mmm . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.869 0.366 . . . . 9.4199999999999999 110.498 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.44 81.6 7.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.488 . . . . 10.67 110.112 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.0 m -96.57 36.95 1.31 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.952 -0.567 . . . . 7.75 111.274 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -89.99 50.37 1.86 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.345 0.593 . . . . 5.6600000000000001 109.549 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.33 56.48 0.83 Allowed Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.216 -1.154 . . . . 3.5699999999999998 110.216 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 tp -129.67 155.66 41.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.338 -0.245 . . . . 4.6799999999999997 110.338 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.2 m -92.23 129.91 42.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.383 -0.371 . . . . 3.27 110.619 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.17 118.44 36.63 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.744 -0.465 . . . . 4.4500000000000002 109.744 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 tttm -56.83 130.65 46.61 Favored 'General case' 0 CA--C 1.519 -0.226 0 O-C-N 123.267 0.355 . . . . 2.8900000000000001 110.516 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.2 t -62.96 124.68 18.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.968 -0.56 . . . . 2.9399999999999999 110.044 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.467 ' OD2' ' HD2' ' A' ' 15' ' ' ARG . 3.0 p30 -78.1 -43.29 29.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.832 -0.433 . . . . 4.4400000000000004 109.832 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HB2' ' H71' ' F' ' 18' ' ' ' DT' . 7.7 tp10 -165.48 -26.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.285 -0.871 . . . . 3.6099999999999999 109.993 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.31 -168.48 2.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.625 . . . . 4.3499999999999996 110.613 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -78.72 64.91 3.55 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.302 -0.475 . . . . 2.0899999999999999 111.979 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HD2' ' OD2' ' A' ' 11' ' ' ASP . 0.3 OUTLIER -117.29 149.11 41.0 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.761 -0.459 . . . . 3.6099999999999999 109.761 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.721 HG22 ' H ' ' A' ' 17' ' ' VAL . 3.7 p -153.52 -173.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.372 -0.376 . . . . 2.3300000000000001 110.046 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.721 ' H ' HG22 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -142.1 -176.89 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.528 -0.306 . . . . 2.4100000000000001 110.788 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -114.82 127.0 27.23 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.176 -0.465 . . . . 3.1499999999999999 110.176 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.608 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 75.6 Cg_exo -51.88 164.65 1.0 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.626 2.884 . . . . 2.71 113.734 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.486 ' HB ' " H4'" ' F' ' 14' ' ' ' DA' . 12.6 tt -92.89 -40.7 12.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 3.73 111.277 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -60.54 -56.19 24.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.361 -0.381 . . . . 4.3099999999999996 111.065 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.2 mt -62.16 -36.21 81.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.109 -0.496 . . . . 3.5800000000000001 110.79 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.608 ' HB2' ' O ' ' A' ' 19' ' ' PRO . 4.1 ttm180 -63.87 -44.25 93.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.479 . . . . 2.9500000000000002 110.446 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -70.02 -30.3 67.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 3.8700000000000001 110.19 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 98.2 m -68.42 -27.97 66.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.755 -0.657 . . . . 4.0899999999999999 111.141 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 66.2 mt -83.03 -14.88 53.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.148 -0.478 . . . . 4.4900000000000002 110.941 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.48 -51.89 4.22 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.901 -0.666 . . . . 3.7400000000000002 111.456 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.7 pt -80.03 80.4 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.445 0.64 . . . . 4.1100000000000003 110.088 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.48 -7.18 38.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.461 -0.79 . . . . 4.9900000000000002 112.013 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.94 -161.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.599 0.238 . . . . 6.1699999999999999 110.919 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 145.6 47.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 4.1200000000000001 111.048 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -153.89 -160.74 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.273 -0.422 . . . . 3.98 110.184 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -116.58 153.97 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.31 -0.405 . . . . 2.9500000000000002 110.275 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 45' ' ' LEU . 37.2 tp -108.84 103.88 13.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.028 0.442 . . . . 2.9500000000000002 110.671 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -89.06 107.06 18.83 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 3.5099999999999998 109.902 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HB ' HG23 ' B' ' 6' ' ' ILE . 13.6 mt -90.45 99.35 9.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.206 0.527 . . . . 2.75 110.061 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -109.5 111.65 23.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.391 -0.822 . . . . 6.1299999999999999 110.361 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.4 t -86.91 110.85 20.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.268 -0.424 . . . . 3.1800000000000002 110.499 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -105.57 104.79 14.59 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.603 -0.517 . . . . 3.6800000000000002 109.603 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.4 t70 69.58 -79.17 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.845 0.716 . . . . 4.2800000000000002 110.284 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -150.03 14.36 0.81 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.594 0.711 . . . . 3.1699999999999999 109.443 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -109.38 136.12 49.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.334 -0.848 . . . . 2.9100000000000001 108.86 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.5 mt -94.25 98.34 8.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.964 0.411 . . . . 2.2599999999999998 110.402 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 41.9 mt -90.69 107.26 18.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.21 0.529 . . . . 3.1000000000000001 110.381 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 9.5 mt -93.71 117.12 29.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.572 -0.74 . . . . 2.4399999999999999 109.443 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -120.29 -172.26 2.33 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 110.159 -0.312 . . . . 5.3899999999999997 110.159 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -136.1 -45.61 0.64 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.097 0.475 . . . . 4.1399999999999997 109.761 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.3 p90 -140.22 -179.48 6.01 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.916 -0.584 . . . . 5.4199999999999999 109.873 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -129.91 110.63 17.12 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 120.956 0.408 . . . . 4.54 110.421 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.574 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 50.8 Cg_exo -54.38 -50.59 12.97 Favored 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.348 2.699 . . . . 5.0199999999999996 113.336 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -66.83 -26.04 66.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.82 0.343 . . . . 6.6799999999999997 111.526 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.8 ttt -76.06 -50.08 15.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.505 -0.316 . . . . 6.4699999999999998 111.109 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.4 t -144.8 -41.21 0.25 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.929 0.344 . . . . 5.7699999999999996 111.929 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 50' ' ' PRO . 12.0 t 65.15 -90.86 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.809 0.444 . . . . 4.5499999999999998 111.216 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.645 0.259 . . . . 6.7999999999999998 110.569 -179.547 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.262 0.553 . . . . 10.279999999999999 109.801 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -73.45 120.68 19.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.499 -0.773 . . . . 9.0299999999999994 109.785 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.8 m -62.52 141.0 58.63 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.157 -0.474 . . . . 6.5800000000000001 111.556 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.64 76.61 4.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.19 0.519 . . . . 5.3399999999999999 110.906 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 149.85 68.7 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.577 -0.738 . . . . 4.1100000000000003 111.345 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.476 HG23 ' HB ' ' A' ' 36' ' ' ILE . 2.9 tp -88.71 117.36 32.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.694 -0.484 . . . . 4.25 109.694 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.28 108.78 21.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.161 0.505 . . . . 3.3199999999999998 111.65 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -102.81 119.39 38.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.737 -0.838 . . . . 4.4699999999999998 108.737 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -64.48 127.26 30.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.834 0.35 . . . . 3.3999999999999999 110.6 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 4.5 m -113.78 -172.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 116.306 -0.406 . . . . 3.48 110.043 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.37 -158.03 0.7 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.242 -0.281 . . . . 4.5199999999999996 110.242 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -95.82 2.03 53.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.291 0.567 . . . . 4.8899999999999997 110.094 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -87.52 158.92 18.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.517 -0.765 . . . . 3.8199999999999998 110.363 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.05 78.02 2.01 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.785 -0.721 . . . . 2.7000000000000002 112.14 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.63 67.73 1.51 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.593 0.235 . . . . 3.7799999999999998 111.384 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 37.9 t -102.65 104.61 16.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.229 -0.656 . . . . 3.0 109.229 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.433 HG11 ' OP2' ' E' ' 7' ' ' ' DG' . 11.2 t -116.62 146.3 21.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 120.727 0.298 . . . . 2.9100000000000001 111.201 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 35.9 pt -98.79 165.77 14.38 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 2.4399999999999999 109.568 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -64.8 87.34 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.53 2.153 . . . . 2.5699999999999998 112.336 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 7.5 pt -93.09 25.13 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-O 121.131 0.491 . . . . 4.2800000000000002 111.136 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.19 -27.07 65.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.717 -0.674 . . . . 4.7400000000000002 109.731 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.39 -37.32 83.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.703 -0.68 . . . . 3.6499999999999999 110.203 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -74.53 -30.81 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.017 0.436 . . . . 3.98 110.038 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' B' ' 24' ' ' ARG . 1.0 OUTLIER -75.86 -19.14 59.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.865 -0.607 . . . . 4.7999999999999998 111.032 179.639 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 3.2 p -104.07 -28.33 11.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.788 0.327 . . . . 4.4100000000000001 111.505 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 20.2 tp -138.1 -74.9 0.4 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.32 -0.4 . . . . 4.8499999999999996 110.621 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 167.34 -170.57 41.65 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.962 -0.637 . . . . 3.6899999999999999 111.74 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 3.6 tp -153.39 144.94 14.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.944 -0.391 . . . . 4.0099999999999998 109.944 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -103.9 -13.41 16.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.025 0.44 . . . . 4.4299999999999997 110.573 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.63 82.0 3.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.995 -0.548 . . . . 5.5599999999999996 110.412 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -118.78 8.01 11.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.266 -0.425 . . . . 4.4699999999999998 110.956 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.05 -67.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.332 -0.395 . . . . 3.96 110.453 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -163.31 144.64 9.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.399 -0.364 . . . . 1.98 110.998 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.4 mp -101.73 145.86 28.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.971 -0.559 . . . . 2.3999999999999999 109.658 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 36.4 tp10 -83.96 120.32 25.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.995 0.426 . . . . 3.0 110.332 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 7.6 mm -117.14 107.61 22.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.098 -0.501 . . . . 2.5 111.107 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -114.63 94.27 4.7 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.686 -0.487 . . . . 4.3899999999999997 109.686 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.601 HG22 HG23 ' B' ' 43' ' ' ILE . 15.5 t -91.61 108.56 20.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.312 -0.404 . . . . 3.6000000000000001 111.272 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -101.14 93.21 5.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.449 -0.574 . . . . 4.7400000000000002 109.449 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.21 -85.18 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.668 -0.696 . . . . 5.3799999999999999 110.623 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -123.46 -2.28 8.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.235 -0.439 . . . . 3.7599999999999998 110.765 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -99.62 100.75 11.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.176 -0.465 . . . . 4.3499999999999996 110.757 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.601 HG23 HG22 ' B' ' 38' ' ' VAL . 33.1 mt -84.62 92.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.124 -0.324 . . . . 2.4199999999999999 110.124 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -85.72 99.25 7.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.659 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 6.0 tt -86.69 128.77 35.03 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.209 -0.663 . . . . 2.3599999999999999 109.209 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -122.95 166.36 15.19 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.28 0.562 . . . . 3.21 111.188 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -108.31 -5.62 16.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.461 -0.791 . . . . 3.6600000000000001 110.99 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -125.4 151.96 45.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.823 0.344 . . . . 5.2000000000000002 110.932 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -165.63 94.57 0.83 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.838 -0.619 . . . . 5.0999999999999996 110.438 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.48 -50.99 1.58 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.201 1.934 . . . . 3.8100000000000001 111.688 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -78.68 103.36 8.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 5.2000000000000002 110.129 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 3.3 mmt -82.95 155.6 23.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.285 -0.416 . . . . 6.1900000000000004 110.443 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 4.1 m -67.19 126.09 28.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 5.4199999999999999 111.427 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' D' ' 54' ' ' CYS . 0.0 OUTLIER -69.79 118.51 12.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.425 -0.583 . . . . 5.5199999999999996 109.425 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 116.284 -0.416 . . . . 6.3799999999999999 111.081 -179.03 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 6.5 tpt . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.618 0.247 . . . . 7.7999999999999998 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -144.44 122.11 11.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.008 0.433 . . . . 8.5700000000000003 110.937 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -129.76 113.39 14.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.192 -0.458 . . . . 5.0099999999999998 110.15 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -79.73 71.98 6.41 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.53 . . . . 4.25 111.411 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.81 123.96 3.77 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.652 -0.785 . . . . 2.4700000000000002 113.014 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -117.48 106.91 20.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.193 -0.669 . . . . 3.96 109.193 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 49.4 t -96.26 92.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.055 0.455 . . . . 2.5299999999999998 110.119 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . 0.45 ' HD3' ' OP1' ' F' ' 6' ' ' ' DT' . 55.3 ttm-85 -112.15 152.43 28.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.87 -0.604 . . . . 3.6000000000000001 110.104 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' D' ' 33' ' ' ALA . 4.1 pttp -75.85 155.41 35.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.89 0.376 . . . . 2.6400000000000001 110.131 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' D' ' 30' ' ' GLU . 31.4 t -66.93 142.61 16.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.058 -0.519 . . . . 2.7000000000000002 110.63 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . 0.4 ' HB3' ' N ' ' C' ' 15' ' ' ARG . 6.8 t70 -70.13 147.89 49.37 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.178 -0.675 . . . . 3.5699999999999998 109.178 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -50.73 -40.91 55.66 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.257 0.348 . . . . 3.21 111.875 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.403 HD23 ' N4 ' ' F' ' 8' ' ' ' DC' . 0.9 OUTLIER -101.6 4.68 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.73 0.3 . . . . 3.3900000000000001 111.652 -178.533 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.21 8.35 66.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.528 -0.844 . . . . 3.1600000000000001 112.848 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' D' ' 17' ' ' VAL . 15.4 mtm180 -75.47 78.06 2.51 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.815 -0.439 . . . . 5.0499999999999998 109.815 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 38.7 t -62.5 122.32 13.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.399 0.619 . . . . 2.6400000000000001 111.135 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . 0.463 HG22 ' HE ' ' D' ' 15' ' ' ARG . 1.9 t -81.5 99.34 4.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.043 -0.981 . . . . 3.4399999999999999 110.726 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.31 124.05 78.89 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 108.053 -1.091 . . . . 3.3399999999999999 108.053 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . 0.548 ' HB2' ' HB2' ' C' ' 22' ' ' LEU . 64.9 Cg_exo -39.31 113.4 0.17 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.174 2.583 . . . . 2.6600000000000001 112.458 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . 0.441 HG12 ' NH2' ' C' ' 24' ' ' ARG . 7.0 tt -56.13 -31.4 31.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.25 -0.887 . . . . 4.46 111.221 -178.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -69.5 -37.37 77.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.106 -0.497 . . . . 4.1799999999999997 110.385 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' C' ' 19' ' ' PRO . 9.3 mp -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.876 -0.416 . . . . 3.5299999999999998 109.876 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' C' ' 23' ' ' ARG . 18.6 mtm180 -60.66 -36.78 79.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.015 -0.538 . . . . 4.2199999999999998 110.231 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . 0.441 ' NH2' HG12 ' C' ' 20' ' ' ILE . 0.0 OUTLIER -76.01 -39.75 55.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.04 -0.527 . . . . 5.04 111.231 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . 0.413 ' OG1' ' HA ' ' C' ' 22' ' ' LEU . 0.7 OUTLIER -74.28 -30.11 61.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.854 0.359 . . . . 4.29 111.961 -178.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mp -86.02 -10.11 55.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.161 -0.311 . . . . 5.0199999999999996 110.161 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 57.23 50.72 62.36 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 116.119 -0.492 . . . . 4.0800000000000001 112.587 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 40.6 pt -115.05 152.4 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.705 0.288 . . . . 4.4699999999999998 111.15 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.92 143.07 41.87 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.148 -0.478 . . . . 3.6899999999999999 110.571 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.52 -9.2 48.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.903 0.382 . . . . 5.5800000000000001 110.637 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . 0.483 ' HA ' ' O ' ' D' ' 11' ' ' ASP . 21.7 mttm -122.2 76.92 1.35 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.527 . . . . 5.1399999999999997 110.491 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -168.31 -157.98 0.22 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.018 -0.364 . . . . 2.8199999999999998 110.018 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.36 154.66 21.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 2.2599999999999998 110.136 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' C' ' 46' ' ' LYS . 2.7 tp -129.95 152.8 49.02 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.245 -0.28 . . . . 2.6600000000000001 110.245 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.507 ' HA ' ' HA ' ' D' ' 7' ' ' VAL . 35.5 tt0 -88.46 124.67 34.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.966 0.412 . . . . 2.25 110.867 -179.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 37.1 mt -98.77 124.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-N 115.72 -0.673 . . . . 2.2400000000000002 110.85 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' D' ' 3' ' ' SER . 54.1 t80 -143.52 162.9 34.63 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.915 -0.772 . . . . 2.3999999999999999 108.915 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' C' ' 43' ' ' ILE . 3.9 m -139.12 149.15 23.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.72 0.295 . . . . 2.5499999999999998 110.549 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 26.5 t70 -132.51 106.26 7.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.454 -0.573 . . . . 2.29 109.454 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.0 t70 71.99 -64.44 0.39 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.992 0.808 . . . . 3.0 111.292 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -150.87 -35.97 0.14 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.936 0.398 . . . . 3.1400000000000001 110.826 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -72.45 145.04 47.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 2.96 110.619 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . 0.556 ' HA ' HG12 ' C' ' 38' ' ' VAL . 36.1 mt -90.9 132.11 36.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.881 -0.6 . . . . 2.3199999999999998 109.801 179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 32.1 mt -111.21 114.53 47.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-O 120.969 0.414 . . . . 2.27 110.525 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . 0.423 ' HB3' HD23 ' C' ' 34' ' ' LEU . 46.4 mt -109.08 132.96 53.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.884 -0.598 . . . . 2.4399999999999999 109.768 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' C' ' 34' ' ' LEU . 0.2 OUTLIER -145.58 166.61 25.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.712 0.292 . . . . 3.02 110.984 -179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 ptpt -58.53 145.59 38.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.641 -0.709 . . . . 2.96 109.863 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -63.96 147.77 51.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.904 0.383 . . . . 4.2000000000000002 110.18 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 mtmp? -134.1 169.95 12.57 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.852 -0.613 . . . . 3.2400000000000002 109.588 -179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.96 73.14 0.34 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.67 2.247 . . . . 3.5 112.08 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -151.41 131.79 13.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.717 -0.674 . . . . 3.7200000000000002 109.789 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 7.2 ttt -127.21 166.97 16.72 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.887 -0.597 . . . . 6.0099999999999998 109.423 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . 0.412 ' O ' ' HB3' ' C' ' 54' ' ' CYS . 2.4 m -80.2 130.33 35.15 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.034 -0.358 . . . . 5.6200000000000001 110.034 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' C' ' 53' ' ' THR . 41.0 t 73.88 -55.81 0.66 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.228 0.611 . . . . 4.1200000000000001 111.437 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 120.687 0.279 . . . . 5.3099999999999996 111.044 -179.626 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.077 0.465 . . . . 3.6899999999999999 110.253 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -70.51 148.94 47.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.76 -0.655 . . . . 3.5699999999999998 110.758 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.494 ' O ' HG22 ' C' ' 38' ' ' VAL . 1.4 m -79.68 40.27 0.44 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.215 0.531 . . . . 2.6400000000000001 111.445 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.73 19.69 19.38 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.236 0.541 . . . . 2.4399999999999999 110.219 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.81 54.86 0.75 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.762 -0.654 . . . . 1.9199999999999999 111.838 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 58.8 mt -130.56 133.89 62.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 110.275 -0.268 . . . . 2.4500000000000002 110.275 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' C' ' 35' ' ' GLU . 35.1 m -79.23 143.32 12.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.194 0.521 . . . . 2.6099999999999999 111.203 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.74 156.51 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 2.77 109.975 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -62.91 131.98 50.54 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.301 0.376 . . . . 3.1499999999999999 110.745 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' C' ' 34' ' ' LEU . 41.2 t -94.27 -87.83 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.994 -0.548 . . . . 3.0800000000000001 109.695 178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.524 ' CG ' ' H ' ' D' ' 12' ' ' GLU . 23.6 t70 179.99 -156.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.477 -0.934 . . . . 4.5899999999999999 108.477 -179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' D' ' 11' ' ' ASP . 6.7 pt-20 -111.35 -6.77 14.45 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.683 -0.488 . . . . 6.0599999999999996 109.683 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.512 ' HA ' HD13 ' D' ' 13' ' ' LEU . 0.2 OUTLIER -123.32 20.36 9.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 4.8399999999999999 111.386 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.53 42.52 88.54 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.872 -0.68 . . . . 3.4300000000000002 112.739 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.606 ' CZ ' ' H73' ' F' ' 6' ' ' ' DT' . 20.8 mtp-105 -123.88 99.82 6.45 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.381 -0.599 . . . . 4.5099999999999998 109.381 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 p -74.0 120.18 22.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.377 0.608 . . . . 2.75 112.475 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.543 ' HA ' ' HA ' ' C' ' 15' ' ' ARG . 18.6 t -81.2 93.79 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.507 -0.77 . . . . 3.3599999999999999 110.159 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -88.26 116.87 67.5 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.796 -0.638 . . . . 3.0800000000000001 109.772 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . 0.564 ' HB3' ' OP1' ' E' ' 16' ' ' ' DT' . 52.4 Cg_exo -39.6 125.66 1.47 Allowed 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 124.118 3.212 . . . . 3.46 113.745 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 pt -64.35 -19.28 24.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.302 -0.408 . . . . 4.8200000000000003 110.484 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -63.33 -29.53 70.82 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 4.9800000000000004 109.637 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' D' ' 26' ' ' LEU . 97.1 mt -71.3 -37.61 71.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.967 -0.753 . . . . 3.25 108.967 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -63.99 -39.43 94.11 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.154 -0.684 . . . . 2.8799999999999999 109.154 178.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -64.78 -30.04 71.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.468 -0.787 . . . . 6.0999999999999996 110.052 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 12.2 m -75.5 -29.52 59.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.758 -0.655 . . . . 3.73 110.463 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 19.8 mt -87.14 -30.92 20.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.789 -0.641 . . . . 2.9700000000000002 110.597 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.11 -10.18 47.29 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.991 -0.623 . . . . 2.79 111.903 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.0 pt -80.64 163.38 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.302 0.572 . . . . 2.1499999999999999 111.777 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.14 -167.93 1.72 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.751 -0.659 . . . . 2.46 110.388 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.543 ' HA ' ' HB ' ' C' ' 10' ' ' VAL . 2.6 pp20? -82.46 -3.14 55.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 3.3999999999999999 111.591 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -97.38 -4.25 38.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.854 0.359 . . . . 3.4399999999999999 110.866 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . 0.44 ' O ' HG23 ' C' ' 10' ' ' VAL . 6.5 m-20 -78.72 152.97 31.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.03 -0.532 . . . . 2.6600000000000001 110.509 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' C' ' 9' ' ' LYS . . . -103.94 133.97 48.0 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.181 -0.463 . . . . 2.2999999999999998 111.634 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 67.5 mt -104.84 128.07 52.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 2.1099999999999999 110.09 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.438 ' HB3' ' HB2' ' D' ' 46' ' ' LYS . 38.5 tt0 -87.87 94.93 9.92 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.743 -0.465 . . . . 2.3399999999999999 109.743 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' D' ' 44' ' ' ILE . 17.8 mt -88.41 114.49 26.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.116 -0.493 . . . . 2.3300000000000001 111.308 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -112.77 -172.86 2.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.564 -0.744 . . . . 2.2400000000000002 109.573 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . 0.41 ' HB ' HD21 ' C' ' 22' ' ' LEU . 14.2 p -139.64 144.13 29.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.802 0.334 . . . . 2.1400000000000001 110.637 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.631 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 14.0 t70 -147.6 117.35 7.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 1.99 110.094 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.63 -94.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 2.7599999999999998 111.425 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -138.18 32.4 2.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.965 0.412 . . . . 2.3500000000000001 110.126 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 39.3 pttt -134.84 157.96 45.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.041 -0.527 . . . . 2.3399999999999999 110.641 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.23 128.42 50.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.711 -0.677 . . . . 1.99 109.916 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' D' ' 36' ' ' ILE . 35.6 mm -99.8 109.23 24.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.827 0.346 . . . . 2.0 110.852 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.51 93.22 5.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.984 0.421 . . . . 2.77 110.595 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.438 ' HB2' ' HB3' ' D' ' 35' ' ' GLU . 58.8 mtpt -87.51 140.9 29.06 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.791 -0.448 . . . . 2.3599999999999999 109.791 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -111.47 159.38 18.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.173 -0.467 . . . . 2.9900000000000002 110.374 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.4 143.7 53.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.954 -0.758 . . . . 3.2599999999999998 108.954 178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -47.78 113.69 2.79 Favored Pre-proline 0 N--CA 1.464 0.243 0 O-C-N 123.412 0.445 . . . . 5.0300000000000002 111.275 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -47.93 -71.53 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.129 2.553 . . . . 3.73 112.885 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' D' ' 52' ' ' MET . 10.8 m120 51.88 -145.45 0.54 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.315 -0.402 . . . . 4.6200000000000001 110.593 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . 0.444 ' H ' ' HB3' ' D' ' 51' ' ' ASN . 42.4 mtt 72.51 -40.85 0.49 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.471 0.709 . . . . 5.29 112.28 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 6.4 m 72.83 152.06 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.056 0.543 . . . . 5.8300000000000001 110.619 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 54' ' ' CYS . 0.1 OUTLIER -58.67 118.06 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.411 -0.359 . . . . 4.5199999999999996 110.626 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.602 -0.714 . . . . 7.0 109.913 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.709 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.434 -0.368 0 O4'-C1'-N19 108.582 0.978 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.709 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.865 0 N19-C1'-C2' 117.363 1.977 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.708 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O3'-P-O5' 100.695 -1.74 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.708 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -0.994 0 O4'-C1'-N19 109.501 2.126 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.634 " C2'" ' H72' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 O4'-C1'-N19 109.481 2.101 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.714 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.579 0 N19-C1'-C2' 117.084 1.803 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.714 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.954 0 O4'-C1'-N19 109.775 2.469 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-N19 109.388 1.984 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.757 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.424 0 O3'-P-O5' 100.057 -2.075 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.757 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O4'-C1'-N19 109.547 2.183 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.54 " C2'" ' H72' ' E' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-N19 109.438 2.047 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.562 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-N19 109.67 2.337 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.565 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 99.448 -2.396 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.565 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 109.658 2.322 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.537 H2'' ' C6 ' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-N19 109.708 2.385 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.576 " H1'" ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.72 0 O4'-C1'-N19 109.724 2.405 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.576 ' C8 ' " H1'" ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.855 0 O4'-C1'-N19 109.555 2.193 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.498 ' C8 ' H2'' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.595 -0.964 0 O4'-C1'-N19 109.581 2.227 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.606 H2'' ' C8 ' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.454 0 O4'-C1'-N19 109.193 1.741 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.606 ' C8 ' H2'' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C1'-N19 109.445 2.056 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.518 H2'' ' C6 ' ' E' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-N19 109.429 2.037 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.518 ' C6 ' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.764 2.455 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.62 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.581 0 O3'-P-O5' 99.988 -2.112 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.65 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.523 0 O3'-P-O5' 100.402 -1.894 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.65 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.846 0 N19-C1'-C2' 116.479 1.425 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.765 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.625 0 O5'-C5'-C4' 111.635 1.025 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.765 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.622 1.212 0 N19-C1'-C2' 116.914 1.696 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.62 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-N19 109.806 2.507 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.472 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.727 0 O4'-C1'-N19 109.709 2.386 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.619 " C2'" ' H72' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.623 0 O4'-C1'-N19 109.834 2.543 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.711 H2'' ' H71' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 O4'-C1'-N19 109.593 2.242 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.711 ' H71' H2'' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 O3'-P-O5' 99.105 -2.576 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.485 H2'' ' C6 ' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.915 0 O3'-P-O5' 98.916 -2.676 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.514 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.722 0 O4'-C1'-N19 109.599 2.249 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.523 H2'' ' C8 ' ' F' ' 11' ' ' ' DA' . . . . . . . . 0 P--O3' 1.6 -0.562 0 O3'-P-O5' 99.803 -2.209 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.523 ' C8 ' H2'' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 O4'-C1'-N19 109.629 2.286 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.464 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.885 0 O3'-P-O5' 99.51 -2.363 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.786 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.656 0 O3'-P-O5' 99.528 -2.354 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.786 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 110.107 2.884 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.443 " H5'" " H1'" ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.881 0 O3'-P-O5' 99.379 -2.432 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.744 H2'' ' N7 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.592 -1.218 0 N19-C1'-C2' 117.819 2.262 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.744 ' N7 ' H2'' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.011 0 O4'-C1'-N19 110.479 3.349 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.408 ' H71' ' HB2' ' A' ' 12' ' ' GLU . . . . . . . . 0 O3'--C3' 1.423 -0.649 0 O3'-P-O5' 99.096 -2.581 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.924 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.804 0 N19-C1'-C2' 117.757 2.223 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.924 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 109.638 2.298 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.539 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.428 0.64 0 O3'-P-O5' 100.414 -1.887 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.71 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.87 -2.174 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.71 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 N19-C1'-C2' 117.339 1.962 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 O4'-C4'-C3' 104.425 -1.175 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.49 ' H71' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.092 1.182 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.475 0.825 0 N-CA-C 109.937 -0.394 . . . . 9.4199999999999999 109.937 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' A' ' 21' ' ' GLU . 20.8 tptp -64.85 132.13 48.63 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 109.355 -0.609 . . . . 10.67 109.355 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.407 ' O ' HG12 ' B' ' 38' ' ' VAL . 1.0 OUTLIER -92.07 24.1 3.45 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 111.981 0.363 . . . . 7.75 111.981 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 m -102.83 65.18 0.89 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.246 0.546 . . . . 5.6600000000000001 111.9 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.21 68.68 1.45 Allowed Glycine 0 N--CA 1.452 -0.252 0 CA-C-N 115.913 -0.585 . . . . 3.5699999999999998 113.267 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.462 HD12 ' HD2' ' A' ' 8' ' ' ARG . 4.6 pt -113.11 131.91 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.7 0.286 . . . . 4.6799999999999997 110.679 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 25.1 t -84.46 105.22 13.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.494 -0.558 . . . . 3.27 109.494 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.462 ' HD2' HD12 ' A' ' 6' ' ' ILE . 39.6 mtp180 -112.27 133.32 54.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.16 -0.473 . . . . 4.4500000000000002 109.936 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.82 138.98 31.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.219 -0.446 . . . . 2.8900000000000001 110.573 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG22 ' H ' ' B' ' 32' ' ' ASP . 3.0 m -85.44 169.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.164 -1.051 . . . . 2.9399999999999999 108.164 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.03 -168.09 1.33 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.248 -0.581 . . . . 4.4400000000000004 112.296 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.67 -32.65 30.49 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.389 -0.823 . . . . 3.6099999999999999 112.964 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.83 -0.5 43.73 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.883 0.327 . . . . 4.3499999999999996 111.883 -178.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.04 33.42 85.61 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.973 -0.632 . . . . 2.0899999999999999 112.603 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.69 ' HD2' ' H72' ' E' ' 6' ' ' ' DT' . 64.2 mtp180 -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.383 -0.228 . . . . 3.6099999999999999 110.383 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -123.24 -175.02 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.055 -0.35 . . . . 2.3300000000000001 110.055 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.552 HG11 " H2'" ' F' ' 16' ' ' ' DT' . 0.6 OUTLIER -137.12 152.96 28.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.64 0.257 . . . . 2.4100000000000001 110.927 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 20.7 pt -87.42 140.83 32.09 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.055 -0.521 . . . . 3.1499999999999999 110.919 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 18' ' ' ILE . 17.4 Cg_exo -68.16 167.89 20.69 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.669 2.246 . . . . 2.71 113.029 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.494 ' HB ' ' OE1' ' D' ' 21' ' ' GLU . 17.4 mm -62.9 -46.58 95.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.571 -0.741 . . . . 3.73 110.695 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' HZ3' ' A' ' 2' ' ' LYS . 20.5 mt-10 -50.93 -46.1 60.78 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.309 0.576 . . . . 4.3099999999999996 110.452 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 tp -63.93 -45.53 88.82 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.189 -0.914 . . . . 3.5800000000000001 110.86 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -59.65 -27.77 66.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.404 . . . . 2.9500000000000002 111.597 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -91.94 -20.33 21.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.105 -0.498 . . . . 3.8700000000000001 111.731 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.41 37.32 4.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 4.0899999999999999 111.132 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 11.9 mt -62.27 -34.57 76.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 4.4900000000000002 111.273 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.32 -30.56 6.69 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.341 -0.704 . . . . 3.7400000000000002 111.341 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.2 pt -85.77 151.3 3.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.693 -0.484 . . . . 4.1100000000000003 109.693 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -91.42 -24.92 19.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.137 0.494 . . . . 4.9900000000000002 110.766 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.78 159.91 40.19 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.643 -0.708 . . . . 6.1699999999999999 110.614 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -83.71 97.25 9.02 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.775 -0.648 . . . . 4.1200000000000001 109.745 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -111.41 -156.25 0.58 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.422 -0.808 . . . . 3.98 110.259 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' B' ' 9' ' ' LYS . . . -93.3 122.64 35.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.74 0.305 . . . . 2.9500000000000002 110.444 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 7' ' ' VAL . 82.4 mt -97.9 158.8 15.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.217 -0.447 . . . . 2.9500000000000002 110.244 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.75 112.78 22.77 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.004 0.43 . . . . 3.5099999999999998 111.112 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.1 mt -100.66 114.46 39.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.167 -0.469 . . . . 2.75 110.922 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -109.31 99.05 8.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.587 -0.279 . . . . 6.1299999999999999 111.273 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.4 t -84.15 117.01 28.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.665 -0.865 . . . . 3.1800000000000002 108.665 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -133.6 115.22 14.41 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.431 0.53 . . . . 3.6800000000000002 112.431 -178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t0 62.38 -91.4 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.391 -0.822 . . . . 4.2800000000000002 112.751 178.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -126.5 7.69 6.99 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 122.339 -0.226 . . . . 3.1699999999999999 111.603 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB3' ' HG2' ' B' ' 46' ' ' LYS . 1.1 pptp? -133.92 147.57 51.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.149 0.499 . . . . 2.9100000000000001 111.331 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' B' ' 45' ' ' LEU . 56.8 mt -110.9 112.81 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.542 -0.754 . . . . 2.2599999999999998 109.948 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mt -92.15 98.6 8.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 3.1000000000000001 110.56 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.37 113.24 23.77 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.889 -0.782 . . . . 2.4399999999999999 108.889 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -121.56 151.82 39.91 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.366 0.603 . . . . 5.3899999999999997 110.98 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -77.7 153.27 33.18 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.328 -0.851 . . . . 4.1399999999999997 110.915 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -79.2 -13.25 59.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.28 0.562 . . . . 5.4199999999999999 110.125 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -155.01 125.04 3.25 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.654 -0.703 . . . . 4.54 109.546 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -57.65 -37.14 97.87 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.769 2.313 . . . . 5.0199999999999996 111.795 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -144.0 120.31 10.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.056 -0.974 . . . . 6.6799999999999997 108.935 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 16.7 tpt -68.25 -67.39 0.47 Allowed 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.018 -0.273 . . . . 6.4699999999999998 110.704 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' CYS . 1.0 OUTLIER -133.55 -83.9 0.45 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.156 0.428 . . . . 5.7699999999999996 112.156 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 53' ' ' THR . 8.8 m 71.41 -63.22 0.43 Allowed 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.589 0.555 . . . . 4.5499999999999998 110.12 -178.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.388 . . . . 6.7999999999999998 110.27 179.608 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 19.4 ptt? . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.67 0.271 . . . . 10.279999999999999 110.667 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttt 56.44 -107.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.642 -0.708 . . . . 9.0299999999999994 110.316 -178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 6.7 m 55.47 39.34 31.08 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.968 0.414 . . . . 6.5800000000000001 111.418 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.2 t -87.79 171.69 10.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.248 -0.433 . . . . 5.3399999999999999 110.369 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.69 81.38 1.34 Allowed Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.019 -0.832 . . . . 4.1100000000000003 111.019 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.3 140.13 49.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 110.264 -0.272 . . . . 4.25 110.264 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -88.78 137.65 20.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.855 0.36 . . . . 3.3199999999999998 110.978 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.18 133.21 38.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.116 -0.493 . . . . 4.4699999999999998 109.858 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 33' ' ' ALA . 11.7 tttt -88.65 134.09 34.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.468 -0.333 . . . . 3.3999999999999999 110.613 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.75 144.63 14.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.992 -0.549 . . . . 3.48 110.424 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . 0.478 ' OD1' ' HB3' ' B' ' 15' ' ' ARG . 0.4 OUTLIER -41.4 -71.4 0.08 Allowed 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.312 0.645 . . . . 4.5199999999999996 111.67 -179.761 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.481 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 45.8 tt0 -163.88 -47.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.176 -0.92 . . . . 4.8899999999999997 109.879 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.6 mt -101.83 -78.09 0.54 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.087 -0.506 . . . . 3.8199999999999998 111.188 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -155.34 122.95 1.27 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.624 -0.798 . . . . 2.7000000000000002 112.568 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.478 ' HB3' ' OD1' ' B' ' 11' ' ' ASP . 16.5 ttm105 -173.31 155.79 2.97 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.154 -0.313 . . . . 3.7799999999999998 110.154 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 93.7 t -105.29 112.69 39.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 121.164 0.507 . . . . 3.0 110.621 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -96.27 60.66 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.305 -0.862 . . . . 2.9100000000000001 111.143 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.57 136.58 80.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 120.884 -0.326 . . . . 2.4399999999999999 110.985 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -46.31 115.11 1.03 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.471 2.781 . . . . 2.5699999999999998 112.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 35.7 mt -77.84 -51.53 17.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.532 -0.758 . . . . 4.2800000000000002 110.725 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.525 ' HG2' ' OP1' ' E' ' 5' ' ' ' DT' . 11.6 mm-40 -53.5 -45.4 69.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.938 -0.574 . . . . 4.7400000000000002 111.227 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.03 -52.48 63.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.972 -0.558 . . . . 3.6499999999999999 111.377 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -64.56 -40.98 96.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.33 -0.395 . . . . 3.98 111.312 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -62.57 -43.63 98.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.963 -0.562 . . . . 4.7999999999999998 111.8 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 6.0 p -81.05 -7.62 59.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 4.4100000000000001 111.377 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.0 tp -75.44 -13.18 60.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 4.8499999999999996 110.553 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.44 -11.25 23.86 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 3.6899999999999999 112.731 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 18.5 pt -113.78 175.86 2.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.888 0.375 . . . . 4.0099999999999998 110.443 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.26 170.84 9.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.059 -0.519 . . . . 4.4299999999999997 109.962 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.489 ' H ' ' CD ' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -97.51 -16.39 20.14 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.266 -0.425 . . . . 5.5599999999999996 110.597 -179.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.498 ' HA ' ' CG2' ' A' ' 10' ' ' VAL . 17.4 mttp -100.45 107.56 19.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.054 -0.521 . . . . 4.4699999999999998 111.034 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 10' ' ' VAL . 1.3 t70 -165.68 -165.65 0.86 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 3.96 110.004 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -108.05 125.51 51.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.41 -0.359 . . . . 1.98 110.271 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.39 140.53 49.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.975 0.417 . . . . 2.3999999999999999 110.96 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -97.23 114.95 26.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.378 -0.601 . . . . 3.0 109.378 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.3 114.06 27.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.022 -0.536 . . . . 2.5 111.62 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -127.62 117.23 21.61 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.222 -0.659 . . . . 4.3899999999999997 109.222 178.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.407 HG12 ' O ' ' A' ' 3' ' ' SER . 7.1 p -101.36 118.93 48.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.509 0.671 . . . . 3.6000000000000001 111.735 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' B' ' 40' ' ' ASP . 28.3 t70 -92.63 97.43 10.79 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.302 -0.999 . . . . 4.7400000000000002 108.302 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' B' ' 39' ' ' ASP . 4.9 m-20 70.84 -74.21 0.09 Allowed 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.772 0.67 . . . . 5.3799999999999999 109.251 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -145.04 6.32 1.15 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 3.7599999999999998 110.532 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 38' ' ' VAL . 29.6 mttp -95.11 113.15 24.81 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.299 -0.63 . . . . 4.3499999999999996 109.299 178.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mt -84.11 101.61 8.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.67 0.271 . . . . 2.4199999999999999 111.116 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 14.4 mt -95.88 107.26 19.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.073 0.463 . . . . 2.6899999999999999 110.369 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' A' ' 43' ' ' ILE . 35.2 mt -90.18 102.8 15.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.813 -0.63 . . . . 2.3599999999999999 110.326 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 42' ' ' LYS . 45.5 mtmt -112.86 -152.98 0.51 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.288 -0.634 . . . . 3.21 109.288 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -153.9 148.04 25.77 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.79 -0.448 . . . . 3.6600000000000001 109.79 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 p90 -70.72 151.17 45.17 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.304 -0.407 . . . . 5.2000000000000002 110.508 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -129.14 108.5 17.96 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 109.642 -0.503 . . . . 5.0999999999999996 109.642 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.13 -70.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.705 2.27 . . . . 3.8100000000000001 111.637 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.48 -93.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.728 0.643 . . . . 5.2000000000000002 111.705 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 15.5 ptm -142.08 18.06 2.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.228 0.537 . . . . 6.1900000000000004 109.812 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.71 96.89 3.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.727 -0.67 . . . . 5.4199999999999999 111.688 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 29.7 m 71.5 -44.66 0.6 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.609 0.763 . . . . 5.5199999999999996 112.788 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 120.674 0.273 . . . . 6.3799999999999999 110.67 -179.758 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.151 0.5 . . . . 7.7999999999999998 111.32 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -122.86 136.67 54.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.948 -0.569 . . . . 8.5700000000000003 109.912 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -101.98 -74.4 0.63 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.562 -0.29 . . . . 5.0099999999999998 110.591 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . . . . . . . . . 2.5 m 49.29 70.74 0.45 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.174 0.511 . . . . 4.25 111.221 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.14 59.26 4.0 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.45 -1.06 . . . . 2.4700000000000002 110.45 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 2.9 tp -82.81 123.94 38.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.179 0.514 . . . . 3.96 111.5 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' D' ' 34' ' ' LEU . 3.6 t -104.97 78.16 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.781 -0.822 . . . . 2.5299999999999998 108.781 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 14.8 ttp85 -118.54 163.66 16.46 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.807 -0.633 . . . . 3.6000000000000001 111.027 -178.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -59.52 131.03 49.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.893 -0.781 . . . . 2.6400000000000001 108.893 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.567 ' HB ' ' O ' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -47.72 -61.15 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 123.507 0.504 . . . . 2.7000000000000002 112.214 -179.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . 0.691 ' OD2' ' HD3' ' C' ' 15' ' ' ARG . 0.0 OUTLIER -166.44 -68.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.967 -0.106 . . . . 3.5699999999999998 110.724 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' C' ' 11' ' ' ASP . 11.7 tp10 171.99 -41.86 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 O-C-N 123.611 0.569 . . . . 3.21 109.685 -179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -118.6 24.98 10.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.015 -0.539 . . . . 3.3900000000000001 111.695 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . 0.585 ' HA3' ' NH2' ' D' ' 23' ' ' ARG . . . 89.18 31.57 11.72 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.576 -0.821 . . . . 3.1600000000000001 114.272 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.691 ' HD3' ' OD2' ' C' ' 11' ' ' ASP . 0.9 OUTLIER -102.25 158.83 15.9 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.374 -0.973 . . . . 5.0499999999999998 108.374 177.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' D' ' 16' ' ' VAL . 57.5 t -119.22 104.21 15.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.612 0.72 . . . . 2.6400000000000001 109.978 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.74 100.38 8.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 114.966 -1.015 . . . . 3.4399999999999999 111.131 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 28.3 mm -98.68 136.02 20.87 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.916 -0.772 . . . . 3.3399999999999999 108.916 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.01 124.45 12.7 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.695 2.263 . . . . 2.6600000000000001 112.26 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 1.6 tp -60.01 -31.6 48.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.264 -0.426 . . . . 4.46 111.154 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . 0.454 ' HG2' ' OP1' ' F' ' 5' ' ' ' DT' . 1.4 tm-20 -58.4 -43.47 88.58 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.537 -0.542 . . . . 4.1799999999999997 109.537 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . . . . . . . . . 24.9 tp -72.13 -37.37 69.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.932 -0.576 . . . . 3.5299999999999998 109.931 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -59.58 -42.28 92.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.164 -0.471 . . . . 4.2199999999999998 110.823 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 -67.28 -39.74 86.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 5.04 110.934 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 1.5 m -77.48 -10.63 59.59 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.033 -0.53 . . . . 4.29 111.24 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -73.47 -48.51 32.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.905 0.384 . . . . 5.0199999999999996 110.808 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.1 57.26 0.68 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.619 -0.801 . . . . 4.0800000000000001 112.28 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 7.1 pt -117.01 127.99 74.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.969 0.414 . . . . 4.4699999999999998 110.555 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.96 -174.07 4.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.046 -0.524 . . . . 3.6899999999999999 111.403 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.494 ' HA ' ' HB3' ' D' ' 12' ' ' GLU . 9.9 tt0 -54.23 -66.42 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.674 -0.694 . . . . 5.5800000000000001 112.166 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -104.55 43.28 1.11 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.136 0.493 . . . . 5.1399999999999997 110.098 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.82 167.89 20.81 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.709 -0.678 . . . . 2.8199999999999998 111.013 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -133.02 154.56 50.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.911 -0.586 . . . . 2.2599999999999998 111.213 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -116.76 149.98 39.03 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.759 -0.655 . . . . 2.6600000000000001 109.26 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -96.46 125.56 41.04 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.485 -0.561 . . . . 2.25 109.485 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 12.2 mt -97.4 120.08 46.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.436 -0.802 . . . . 2.2400000000000002 110.879 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . 0.418 ' HA ' ' O ' ' D' ' 3' ' ' SER . 69.0 t80 -140.06 155.87 46.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.342 -0.844 . . . . 2.3999999999999999 108.763 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . 0.478 HG22 ' HB2' ' D' ' 3' ' ' SER . 16.0 m -123.83 153.14 29.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.261 0.553 . . . . 2.5499999999999998 111.883 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' C' ' 42' ' ' LYS . 17.9 t70 -135.36 102.88 5.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.319 -0.855 . . . . 2.29 109.129 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 67.61 -90.82 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.568 0.543 . . . . 3.0 110.825 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -131.48 9.1 4.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.165 0.507 . . . . 3.1400000000000001 110.096 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . 0.485 ' HD3' ' O ' ' C' ' 39' ' ' ASP . 0.5 OUTLIER -110.81 146.98 35.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 2.96 109.539 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . . . . . . . . . 12.7 mt -103.22 136.05 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 120.826 0.346 . . . . 2.3199999999999998 110.769 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 75.6 mt -111.33 109.21 27.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.833 -0.621 . . . . 2.27 110.259 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.86 112.91 24.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.211 -0.663 . . . . 2.4399999999999999 109.211 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . 0.483 ' HB3' ' CB ' ' D' ' 42' ' ' LYS . 12.5 pttp -144.96 174.79 10.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.069 0.461 . . . . 3.02 111.88 -178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -71.39 144.99 49.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.499 -0.773 . . . . 2.96 110.117 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -95.05 167.52 11.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.22 0.533 . . . . 4.2000000000000002 111.15 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 15.9 pttm -117.39 158.07 45.75 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.421 -0.809 . . . . 3.2400000000000002 109.906 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -44.89 106.94 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.232 2.621 . . . . 3.5 113.497 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -159.4 158.47 32.23 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.448 -0.575 . . . . 3.7200000000000002 109.448 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -96.99 145.52 25.86 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.053 0.454 . . . . 6.0099999999999998 111.141 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.92 131.12 53.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.086 -0.506 . . . . 5.6200000000000001 110.557 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . . . . . . . . . 6.2 t 66.85 16.44 10.37 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.059 0.457 . . . . 4.1200000000000001 111.138 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.544 . . . . 5.3099999999999996 109.695 -179.719 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 53.6 mtt . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.873 0.368 . . . . 3.6899999999999999 111.011 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . 0.542 ' H ' HD12 ' D' ' 6' ' ' ILE . 32.3 mmmt -132.97 176.76 8.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.861 -0.609 . . . . 3.5699999999999998 109.534 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.478 ' HB2' HG22 ' C' ' 38' ' ' VAL . 2.1 p -92.15 21.68 4.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.837 0.351 . . . . 2.6400000000000001 111.87 -178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.2 37.15 1.18 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.878 0.37 . . . . 2.4399999999999999 111.472 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.01 46.11 29.75 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 110.803 -0.919 . . . . 1.9199999999999999 110.803 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . 0.542 HD12 ' H ' ' D' ' 2' ' ' LYS . 3.7 mt -97.31 140.07 18.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.798 0.332 . . . . 2.4500000000000002 110.766 -178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -78.28 141.32 15.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.791 -0.64 . . . . 2.6099999999999999 112.675 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' D' ' 9' ' ' LYS . 4.5 tmt_? -150.03 130.13 13.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.105 -0.952 . . . . 2.77 109.059 179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . 0.419 ' O ' ' HD3' ' D' ' 8' ' ' ARG . 13.7 tmtt? -57.13 137.3 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.167 0.292 . . . . 3.1499999999999999 111.159 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.797 HG13 ' H ' ' D' ' 11' ' ' ASP . 3.0 p -105.26 -100.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 116.55 -0.295 . . . . 3.0800000000000001 110.76 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.797 ' H ' HG13 ' D' ' 10' ' ' VAL . 3.8 t70 -162.73 149.05 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.261 0.482 . . . . 4.5899999999999999 110.306 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.494 ' HB3' ' HA ' ' C' ' 30' ' ' GLU . 0.6 OUTLIER -63.44 -27.33 69.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.723 -0.671 . . . . 6.0599999999999996 112.114 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.414 ' HB2' ' NH1' ' D' ' 15' ' ' ARG . 1.0 OUTLIER -97.59 -42.18 7.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 4.8399999999999999 110.949 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.14 24.7 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.798 -0.715 . . . . 3.4300000000000002 112.911 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' D' ' 13' ' ' LEU . 34.8 mtt85 -74.64 117.96 17.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 4.5099999999999998 109.609 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.555 ' HB ' ' HB ' ' C' ' 16' ' ' VAL . 20.8 t -103.66 163.31 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.409 -0.589 . . . . 2.75 109.409 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' C' ' 15' ' ' ARG . 2.9 p -150.93 159.22 4.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.646 0.26 . . . . 3.3599999999999999 110.788 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . 0.46 HG13 ' O ' ' C' ' 14' ' ' GLY . 0.6 OUTLIER -115.22 98.54 50.73 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.569 -0.53 . . . . 3.0800000000000001 109.569 177.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . 0.656 ' HA ' ' OP1' ' E' ' 15' ' ' ' DT' . 45.9 Cg_exo -59.07 162.69 13.19 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 123.062 2.508 . . . . 3.46 112.504 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 28.1 mt -51.66 -42.71 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.871 -0.604 . . . . 4.8200000000000003 111.066 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . 0.494 ' OE1' ' HB ' ' A' ' 20' ' ' ILE . 0.4 OUTLIER -57.64 -43.57 84.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.581 -0.736 . . . . 4.9800000000000004 110.552 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . . . . . . . . . 5.6 mp -70.03 -37.71 75.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.281 -0.418 . . . . 3.25 110.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . 0.585 ' NH2' ' HA3' ' C' ' 14' ' ' GLY . 78.8 mtt180 -61.75 -42.25 98.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.222 0.534 . . . . 2.8799999999999999 109.936 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.27 -39.2 86.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.283 -0.871 . . . . 6.0999999999999996 111.157 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -70.76 -46.24 63.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 3.73 111.068 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 44.5 mt -70.37 -32.11 69.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.044 -0.525 . . . . 2.9700000000000002 110.364 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.87 40.66 43.85 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.374 -0.69 . . . . 2.79 111.374 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -122.98 175.86 5.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.012 0.434 . . . . 2.1499999999999999 111.021 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.83 163.82 12.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.821 -0.627 . . . . 2.46 109.604 178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.505 ' HB2' ' N ' ' C' ' 14' ' ' GLY . 2.4 pt-20 -76.14 -4.1 39.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.157 0.503 . . . . 3.3999999999999999 110.987 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -119.66 17.3 12.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.633 -0.712 . . . . 3.4399999999999999 109.727 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -96.78 -172.96 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.65 -0.705 . . . . 2.6600000000000001 110.523 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -111.85 154.33 25.3 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.092 -0.503 . . . . 2.2999999999999998 111.164 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.471 ' O ' ' HA ' ' C' ' 7' ' ' VAL . 12.7 mt -133.42 146.53 51.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.953 -0.567 . . . . 2.1099999999999999 109.65 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -89.32 97.49 11.23 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.217 -0.66 . . . . 2.3399999999999999 109.217 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 19.7 mt -96.22 109.35 22.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.051 -0.522 . . . . 2.3300000000000001 111.478 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -118.7 144.49 46.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.14 -0.482 . . . . 2.2400000000000002 109.809 179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -101.96 120.01 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.96 0.409 . . . . 2.1400000000000001 110.36 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 17.1 t70 -112.33 103.57 11.7 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.292 -0.413 . . . . 1.99 109.906 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 35.8 t70 61.43 -94.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 2.7599999999999998 110.863 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.46 25.0 5.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.723 0.297 . . . . 2.3500000000000001 111.107 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.483 ' CB ' ' HB3' ' C' ' 46' ' ' LYS . 0.5 OUTLIER -131.43 151.35 51.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.373 . . . . 2.3399999999999999 111.267 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 38.6 mt -96.74 116.41 38.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 1.99 109.532 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 26.4 mm -95.55 111.0 25.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.879 -0.6 . . . . 2.0 110.39 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -97.5 110.29 22.88 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.398 -0.594 . . . . 2.77 109.398 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 46' ' ' LYS . 24.3 mtpt -111.39 152.44 27.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.869 -0.605 . . . . 2.3599999999999999 111.291 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -91.55 178.51 5.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.503 -0.772 . . . . 2.9900000000000002 109.722 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -106.45 176.68 5.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.531 -0.544 . . . . 3.2599999999999998 109.531 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -65.19 118.06 46.01 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.426 -0.352 . . . . 5.0300000000000002 110.316 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . 0.408 ' HB2' ' SD ' ' D' ' 52' ' ' MET . 17.5 Cg_endo -61.54 -58.3 0.44 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.032 1.822 . . . . 3.73 111.258 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 63.3 t30 49.64 43.79 24.33 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.849 -0.614 . . . . 4.6200000000000001 111.611 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' D' ' 50' ' ' PRO . 0.0 OUTLIER -132.53 163.0 29.8 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.366 -0.379 . . . . 5.29 110.33 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -169.64 1.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.25 -0.432 . . . . 5.8300000000000001 109.917 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 2.3 t -87.93 50.24 1.95 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.587 0.708 . . . . 4.5199999999999996 109.583 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 C--O 1.244 0.805 0 CA-C-N 115.371 -0.831 . . . . 7.0 110.153 -179.631 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.717 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-N19 108.586 0.983 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.717 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 117.153 1.846 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.705 ' C8 ' H2'' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.579 2.223 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.652 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-N19 109.198 1.747 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.602 H2'' ' C5 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.394 1.993 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.69 ' H72' ' HD2' ' A' ' 15' ' ' ARG . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 N19-C1'-C2' 117.229 1.893 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.572 H2'' ' C8 ' ' E' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.736 0 O3'-P-O5' 100.284 -1.956 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.572 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O3'-P-O5' 100.661 -1.757 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.665 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 O4'-C1'-N19 109.535 2.169 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.665 ' C8 ' H2'' ' E' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O3'-P-O5' 100.453 -1.867 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-N19 109.537 2.171 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.569 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O3'-P-O5' 99.721 -2.252 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.591 H2'' ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O3'-P-O5' 99.993 -2.109 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.591 ' C8 ' H2'' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 O4'-C1'-N19 109.537 2.171 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.656 ' OP1' ' HA ' ' D' ' 19' ' ' PRO . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O4'-C1'-N19 109.988 2.735 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.643 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 O4'-C1'-N19 109.78 2.475 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.643 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 O4'-C1'-N19 109.956 2.695 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.599 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.17 0 O3'-P-O5' 99.64 -2.295 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.599 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-N19 109.386 1.983 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.623 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.903 0 O3'-P-O5' 100.588 -1.796 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.623 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-N19 109.404 2.006 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.516 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 O4'-C1'-N19 109.76 2.45 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.681 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.651 0 O4'-C1'-N19 109.514 2.143 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.733 H2'' ' H71' ' E' ' 25' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O3'-P-O5' 100.746 -1.713 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.733 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.968 1.105 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.74 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C5'-C4'-O4' 108.221 -0.737 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.74 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 N19-C1'-C2' 117.113 1.82 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.607 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-N19 110.042 2.802 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.427 " C2'" ' H72' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.809 0 O4'-C1'-N19 109.944 2.68 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.664 H2'' ' H71' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.797 0 O3'-P-O5' 99.837 -2.191 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.664 ' H71' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-N19 109.681 2.351 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.53 H2'' ' C6 ' ' F' ' 8' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 O3'-P-O5' 99.471 -2.384 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.53 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.662 0 O3'-P-O5' 99.3 -2.474 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.68 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.596 -0.898 0 O3'-P-O5' 100.094 -2.056 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.68 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.924 0 O4'-C1'-N19 110.147 2.933 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.482 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O3'-P-O5' 99.482 -2.378 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.533 H2'' ' C8 ' ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.42 -0.877 0 O3'-P-O5' 99.809 -2.206 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.787 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.798 0 O3'-P-O5' 99.723 -2.251 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.787 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 O4'-C1'-N19 110.166 2.957 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.698 H2'' ' H71' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.423 -0.645 0 O3'-P-O5' 99.251 -2.499 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' F' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.421 -0.782 0 O3'-P-O5' 99.682 -2.273 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.589 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O3'-P-O5' 99.432 -2.404 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.58 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.42 -0.864 0 O3'-P-O5' 99.166 -2.544 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.63 H2'' ' C8 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.418 -0.992 0 O3'-P-O5' 99.068 -2.596 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.695 H2'' ' C8 ' ' F' ' 21' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.203 0 O3'-P-O5' 99.67 -2.279 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.695 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.593 -1.2 0 O4'-C1'-N19 109.554 2.192 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.51 ' H72' " H2'" ' F' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.826 0 O3'-P-O5' 100.02 -2.095 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.682 H2'' ' N7 ' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.742 0 O3'-P-O5' 99.629 -2.3 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.682 ' N7 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.843 0 O3'-P-O5' 101.552 -1.289 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . 0.443 ' C6 ' H2'' ' F' ' 24' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 116.391 1.369 . . . . 4.96 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.598 0.237 . . . . 9.4199999999999999 111.132 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' D' ' 25' ' ' THR . 0.1 OUTLIER -120.48 166.79 13.12 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.281 -0.266 . . . . 10.67 110.281 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -91.7 6.91 44.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.823 0.344 . . . . 7.75 111.27 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.38 78.45 9.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.899 0.38 . . . . 5.6600000000000001 111.259 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.57 57.53 1.84 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.625 -0.797 . . . . 3.5699999999999998 111.978 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.79 145.91 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.631 0.253 . . . . 4.6799999999999997 110.336 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 41.3 t -95.01 118.65 41.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.881 0.372 . . . . 3.27 110.417 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.75 -153.76 0.58 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.26 -0.644 . . . . 4.4500000000000002 109.26 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -106.68 161.1 14.95 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.137 -0.69 . . . . 2.8900000000000001 109.137 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.7 m -68.2 -165.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 123.315 0.384 . . . . 2.9399999999999999 110.949 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' B' ' 22' ' ' LEU . 10.4 t0 -55.99 118.23 4.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.486 -0.561 . . . . 4.4400000000000004 109.486 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' B' ' 23' ' ' ARG . 1.7 mt-10 -102.74 -33.26 9.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.013 -0.54 . . . . 3.6099999999999999 110.941 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' HB3' ' H73' ' F' ' 16' ' ' ' DT' . 0.3 OUTLIER -170.74 42.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.118 0.485 . . . . 4.3499999999999996 110.68 -179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.13 -53.48 4.64 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 114.474 0.55 . . . . 2.0899999999999999 114.474 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.455 ' HG2' HG22 ' B' ' 17' ' ' VAL . 8.3 mtt-85 -65.55 107.1 1.6 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.052 0.454 . . . . 3.6099999999999999 112.014 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.541 ' HB ' HG13 ' B' ' 16' ' ' VAL . 86.9 t -103.72 137.16 33.45 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.832 0.825 . . . . 2.3300000000000001 110.699 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.44 ' HA ' ' HG2' ' B' ' 15' ' ' ARG . 23.4 t -65.34 146.86 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 113.932 -1.485 . . . . 2.4100000000000001 112.172 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' O ' ' HD2' ' B' ' 15' ' ' ARG . 0.1 OUTLIER -161.58 151.75 14.39 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 107.66 -1.237 . . . . 3.1499999999999999 107.66 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HG2' HG11 ' B' ' 38' ' ' VAL . 78.0 Cg_exo -51.57 112.28 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.323 2.016 . . . . 2.71 112.421 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.66 -29.68 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.769 -0.456 . . . . 3.73 109.769 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HG2' ' N ' ' A' ' 22' ' ' LEU . 3.2 pm0 -63.19 -41.68 99.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.656 -0.702 . . . . 4.3099999999999996 109.187 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.429 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 26.7 tp -68.69 -42.31 77.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.437 -0.801 . . . . 3.5800000000000001 109.795 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -39.84 75.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 2.9500000000000002 111.273 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.79 -22.37 46.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.39 0.515 . . . . 3.8700000000000001 112.39 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.4 p -120.84 28.21 8.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.77 0.319 . . . . 4.0899999999999999 111.484 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.5 mt -49.63 -54.43 18.51 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.792 -0.64 . . . . 4.4900000000000002 111.692 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.89 91.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.61 -0.805 . . . . 3.7400000000000002 112.087 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.9 pp -135.12 165.82 29.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 110.464 -0.198 . . . . 4.1100000000000003 110.464 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.53 -42.67 6.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.327 0.584 . . . . 4.9900000000000002 110.067 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.62 179.24 6.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.549 -0.75 . . . . 6.1699999999999999 109.955 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 10' ' ' VAL . 23.4 tttp -75.29 87.71 2.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.089 -0.505 . . . . 4.1200000000000001 109.684 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -86.22 -170.58 3.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.517 -0.765 . . . . 3.98 110.036 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB1' ' HB ' ' B' ' 7' ' ' VAL . . . -144.34 119.25 9.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.112 0.482 . . . . 2.9500000000000002 111.174 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.426 ' HB2' ' HB3' ' B' ' 8' ' ' ARG . 5.7 mp -70.36 149.07 47.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.734 -0.667 . . . . 2.9500000000000002 109.846 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' LEU . 10.7 mm-40 -86.52 130.37 34.52 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.1 -0.5 . . . . 3.5099999999999998 110.762 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' B' ' 8' ' ' ARG . 58.0 mt -122.24 104.66 15.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.209 -0.45 . . . . 2.75 110.629 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.574 ' HA ' ' O ' ' B' ' 4' ' ' THR . 76.4 t80 -90.18 121.96 32.69 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.347 -0.612 . . . . 6.1299999999999999 109.347 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 m -110.1 118.41 56.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.217 0.532 . . . . 3.1800000000000002 112.094 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.406 ' HB2' ' CE2' ' A' ' 37' ' ' TYR . 7.7 t70 -131.27 76.0 1.69 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.719 -0.673 . . . . 3.6800000000000002 109.314 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 64.61 -93.31 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.504 -0.771 . . . . 4.2800000000000002 110.895 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -102.65 -18.92 15.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.081 -0.508 . . . . 3.1699999999999999 111.115 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -93.11 113.89 26.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 2.9100000000000001 110.708 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.411 ' HB ' HD12 ' B' ' 45' ' ' LEU . 19.8 mt -116.48 121.35 67.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.843 -0.617 . . . . 2.2599999999999998 109.84 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -110.55 115.4 49.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.533 -0.303 . . . . 3.1000000000000001 110.418 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' B' ' 43' ' ' ILE . 4.3 mp -110.86 132.88 53.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.5 -0.318 . . . . 2.4399999999999999 110.16 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -136.19 142.87 44.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.487 -0.324 . . . . 5.3899999999999997 110.769 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HB2' ' HB2' ' B' ' 41' ' ' GLU . 52.7 tttt -66.43 -71.99 0.18 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.831 -0.622 . . . . 4.1399999999999997 110.399 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' O ' ' HD3' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -172.67 -143.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.415 -0.587 . . . . 5.4199999999999999 109.415 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -112.93 91.97 19.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 N-CA-C 110.228 -0.286 . . . . 4.54 110.228 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 48' ' ' TYR . 28.2 Cg_exo -63.13 -30.2 75.04 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.83 2.353 . . . . 5.0199999999999996 112.875 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -89.88 69.52 7.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.398 0.618 . . . . 6.6799999999999997 110.207 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 41.3 ttm -125.18 42.34 3.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.763 -0.653 . . . . 6.4699999999999998 109.876 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m 66.6 78.36 0.26 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.384 -0.825 . . . . 5.7699999999999996 111.446 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -76.93 -33.47 57.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.906 0.384 . . . . 4.5499999999999998 110.222 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.466 ' NE2' ' HB2' ' C' ' 52' ' ' MET . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.71 -0.677 . . . . 6.7999999999999998 109.728 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.911 0.386 . . . . 10.279999999999999 110.62 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -82.14 -21.23 36.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.373 0.606 . . . . 9.0299999999999994 109.891 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 p -147.19 -79.13 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.336 -0.847 . . . . 6.5800000000000001 109.183 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.574 ' O ' ' HA ' ' A' ' 37' ' ' TYR . 0.2 OUTLIER -121.99 -54.95 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.16 -0.473 . . . . 5.3399999999999999 110.081 178.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 144.36 -82.1 0.21 Allowed Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.507 -0.854 . . . . 4.1100000000000003 112.297 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.08 -179.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.684 0.278 . . . . 4.25 110.669 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.412 ' HB ' ' HB1' ' A' ' 33' ' ' ALA . 3.3 m -138.12 153.09 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.191 -0.459 . . . . 3.3199999999999998 110.868 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.556 ' HB2' HD11 ' A' ' 36' ' ' ILE . 2.3 tmt_? -117.96 98.0 6.11 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.662 -0.496 . . . . 4.4699999999999998 109.662 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -63.87 143.13 58.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.236 -0.438 . . . . 3.3999999999999999 110.535 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' VAL . . . . . 0.484 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 78.3 t -71.79 98.46 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.499 0.666 . . . . 3.48 110.439 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -121.89 -179.82 4.26 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.233 -0.894 . . . . 4.5199999999999996 109.509 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -78.26 3.18 16.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.415 -0.357 . . . . 4.8899999999999997 111.129 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' B' ' 13' ' ' LEU . 2.3 mm? -59.6 129.52 42.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.554 . . . . 3.8199999999999998 109.846 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . 0.402 ' HA3' " O5'" ' F' ' 14' ' ' ' DA' . . . -59.42 -42.65 97.62 Favored Glycine 0 N--CA 1.452 -0.249 0 CA-C-N 115.982 -0.554 . . . . 2.7000000000000002 114.105 -178.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.515 ' HD2' ' O ' ' A' ' 18' ' ' ILE . 0.1 OUTLIER -132.05 -155.67 0.7 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 117.205 0.503 . . . . 3.7799999999999998 111.382 -179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.541 HG13 ' HB ' ' A' ' 16' ' ' VAL . 2.9 p -107.42 119.65 57.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 119.706 -0.797 . . . . 3.0 110.92 -178.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.455 HG22 ' HG2' ' A' ' 15' ' ' ARG . 21.5 t -101.85 104.96 17.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.359 0.6 . . . . 2.9100000000000001 110.841 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 19' ' ' PRO . 31.4 mm -84.82 146.67 46.73 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 114.956 -1.02 . . . . 2.4399999999999999 108.61 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.471 ' HD2' HG23 ' B' ' 18' ' ' ILE . 68.9 Cg_exo -41.08 119.57 0.9 Allowed 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.346 2.031 . . . . 2.5699999999999998 112.846 178.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ILE . . . . . 0.41 ' H ' HG13 ' B' ' 20' ' ' ILE . 19.6 mt -58.15 -22.11 18.74 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-N 115.888 -0.596 . . . . 4.2800000000000002 111.34 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.42 -15.72 39.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.754 . . . . 4.7400000000000002 111.583 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.401 ' HB3' ' OD2' ' A' ' 11' ' ' ASP . 40.8 tp -60.58 -76.56 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 O-C-N 123.159 0.287 . . . . 3.6499999999999999 110.91 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.444 ' HA ' ' HB2' ' B' ' 26' ' ' LEU . 14.9 ttt180 -61.0 -36.91 80.73 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.612 0.244 . . . . 3.98 111.214 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.544 ' HA ' ' HE ' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -60.24 -33.77 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.423 0.527 . . . . 4.7999999999999998 112.423 -178.5 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.38 13.65 16.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.953 0.406 . . . . 4.4100000000000001 111.175 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' B' ' 23' ' ' ARG . 0.6 OUTLIER -67.25 -45.59 76.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.127 -0.488 . . . . 4.8499999999999996 110.81 -179.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.88 32.4 26.8 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.855 -0.688 . . . . 3.6899999999999999 111.951 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 21.5 pt -85.33 172.16 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.84 0.352 . . . . 4.0099999999999998 110.855 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.06 -62.67 1.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.112 -0.495 . . . . 4.4299999999999997 111.297 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' B' ' 31' ' ' LYS . 0.5 OUTLIER -154.65 -69.48 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.055 0.391 . . . . 5.5599999999999996 112.055 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 30' ' ' GLU . 11.4 pttp -140.79 167.77 21.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.352 -0.385 . . . . 4.4699999999999998 111.19 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -152.68 152.12 31.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 3.96 109.726 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.55 122.01 30.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.115 0.483 . . . . 1.98 111.473 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' B' ' 45' ' ' LEU . 17.7 tp -115.1 123.98 50.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.631 -0.713 . . . . 2.3999999999999999 110.042 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 48' ' ' TYR . 35.6 tt0 -89.99 116.79 28.3 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.942 -0.572 . . . . 3.0 110.171 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 66.1 mt -96.05 102.04 13.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.134 -0.485 . . . . 2.5 110.46 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -105.95 129.5 54.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.195 -0.457 . . . . 4.3899999999999997 109.815 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.454 HG11 ' HG2' ' A' ' 19' ' ' PRO . 58.1 t -123.16 123.62 68.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 120.976 0.417 . . . . 3.6000000000000001 110.813 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.446 ' O ' ' HE3' ' B' ' 42' ' ' LYS . 19.8 t0 -123.59 93.84 4.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.585 -0.734 . . . . 4.7400000000000002 109.652 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 65.31 -88.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.627 -0.715 . . . . 5.3799999999999999 110.884 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -125.0 16.7 8.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.51 0.671 . . . . 3.7599999999999998 110.554 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' B' ' 39' ' ' ASP . 22.0 mtmt -112.41 116.11 29.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.311 -0.858 . . . . 4.3499999999999996 110.294 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 3.7 mp -109.63 118.84 57.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.848 -0.427 . . . . 2.4199999999999999 109.848 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -111.69 113.99 45.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.224 -0.444 . . . . 2.6899999999999999 111.546 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.419 ' HB3' HD21 ' B' ' 34' ' ' LEU . 55.0 mt -102.52 102.24 12.5 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.33 -0.989 . . . . 2.3599999999999999 108.33 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -138.65 -172.24 3.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.393 -0.367 . . . . 3.21 110.902 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -73.25 158.5 35.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.087 0.47 . . . . 3.6600000000000001 110.717 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' TYR . . . . . 0.44 ' HA ' ' HB2' ' B' ' 35' ' ' GLU . 35.8 p90 -67.29 145.6 54.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.614 -0.721 . . . . 5.2000000000000002 111.046 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -82.47 157.21 67.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.287 -0.415 . . . . 5.0999999999999996 109.942 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -75.22 49.36 2.29 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.863 2.375 . . . . 3.8100000000000001 112.641 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -152.4 141.83 21.64 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.484 -0.562 . . . . 5.2000000000000002 109.484 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' MET . . . . . . . . . . . . . 24.6 ptp -132.36 -179.41 5.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.721 0.296 . . . . 6.1900000000000004 110.454 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.52 155.56 39.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.007 -0.542 . . . . 5.4199999999999999 110.532 179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.4 115.85 15.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.399 -0.364 . . . . 5.5199999999999996 111.238 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 116.214 -0.448 . . . . 6.3799999999999999 110.073 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.32 0.581 . . . . 7.7999999999999998 110.168 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' LYS . . . . . 0.451 ' HG2' ' OG1' ' C' ' 4' ' ' THR . 44.1 tttm -167.05 100.15 0.53 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 8.5700000000000003 109.535 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 46.96 0.35 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.579 0.585 . . . . 5.0099999999999998 112.579 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' C' ' 2' ' ' LYS . 0.6 OUTLIER -108.7 30.67 6.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.569 0.699 . . . . 4.25 109.763 179.229 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 66.7 0.54 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.557 -0.747 . . . . 2.4700000000000002 112.187 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -84.79 121.2 36.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.562 0.22 . . . . 3.96 110.985 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 21.3 t -87.51 111.43 21.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.398 -0.593 . . . . 2.5299999999999998 109.398 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -112.29 126.79 55.63 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.46 . . . . 3.6000000000000001 110.946 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . . . . . . . . . 23.8 tttm -77.13 133.8 38.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.727 -0.67 . . . . 2.6400000000000001 109.673 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.46 -179.4 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.806 -0.442 . . . . 2.7000000000000002 109.806 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' ASP . . . . . 0.649 ' HB3' ' OP1' ' F' ' 7' ' ' ' DT' . 8.9 m-20 -130.5 -150.8 0.44 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.671 -0.863 . . . . 3.5699999999999998 108.671 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' D' ' 30' ' ' GLU . 40.0 mt-10 -70.53 -6.32 35.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.284 0.564 . . . . 3.21 109.659 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.844 HD11 ' HA ' ' D' ' 20' ' ' ILE . 1.1 tp -131.95 -179.21 5.27 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.215 -0.902 . . . . 3.3900000000000001 108.923 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' D' ' 18' ' ' ILE . . . -85.8 95.09 1.98 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.206 -0.997 . . . . 3.1600000000000001 112.547 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . 0.542 HH21 " C4'" ' F' ' 5' ' ' ' DT' . 0.0 OUTLIER -105.89 83.22 1.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.448 0.166 . . . . 5.0499999999999998 111.448 -179.17 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.543 ' HB ' ' CG1' ' D' ' 16' ' ' VAL . 0.9 OUTLIER -112.19 123.42 67.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.33 -0.548 . . . . 2.6400000000000001 110.028 179.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' VAL . . . . . 0.534 ' HA ' ' HA ' ' D' ' 15' ' ' ARG . 21.9 t -101.88 97.13 5.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.356 0.502 . . . . 3.4399999999999999 112.356 -178.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 22.1 mm -80.1 129.95 68.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.143 -0.688 . . . . 3.3399999999999999 109.143 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.47 135.44 70.29 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.439 2.092 . . . . 2.6600000000000001 112.886 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 7.2 tp -64.99 -24.33 35.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.197 -0.456 . . . . 4.46 110.428 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.34 -38.72 69.13 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.792 -0.64 . . . . 4.1799999999999997 110.349 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' LEU . . . . . 0.665 ' O ' ' HG ' ' C' ' 26' ' ' LEU . 28.5 mt -62.91 -43.02 99.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.985 -0.552 . . . . 3.5299999999999998 110.495 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' C' ' 30' ' ' GLU . 38.7 ttm-85 -61.09 -39.66 90.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 4.2199999999999998 110.728 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.19 -13.3 60.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.19 0.519 . . . . 5.04 110.771 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -94.14 -36.26 12.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.928 -0.578 . . . . 4.29 109.885 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' C' ' 22' ' ' LEU . 28.3 mt -78.61 -40.17 35.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 5.0199999999999996 110.54 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.52 60.74 2.29 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.736 -0.745 . . . . 4.0800000000000001 112.382 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 16.1 pt -130.6 176.33 8.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.578 0.228 . . . . 4.4699999999999998 110.748 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 179.67 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 3.6899999999999999 111.189 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' C' ' 23' ' ' ARG . 0.0 OUTLIER -95.86 -78.54 0.46 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.469 -0.332 . . . . 5.5800000000000001 110.792 -179.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' D' ' 10' ' ' VAL . 35.3 mtmm -90.45 76.18 6.69 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.243 0.545 . . . . 5.1399999999999997 109.847 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.11 -155.74 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.616 -0.72 . . . . 2.8199999999999998 110.091 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' D' ' 8' ' ' ARG . . . -135.01 130.78 36.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.701 0.286 . . . . 2.2599999999999998 110.696 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' D' ' 7' ' ' VAL . 76.2 mt -120.54 155.51 33.5 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.547 -0.538 . . . . 2.6600000000000001 109.547 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' C' ' 48' ' ' TYR . 8.9 pt-20 -86.59 130.96 34.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.365 0.602 . . . . 2.25 111.624 -178.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . . . . . . . . . 8.0 mt -97.4 124.57 50.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.274 -0.875 . . . . 2.2400000000000002 110.069 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -144.31 137.08 26.94 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.055 -0.72 . . . . 2.3999999999999999 109.055 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . 0.48 HG13 ' CB ' ' D' ' 3' ' ' SER . 1.7 m -102.22 138.5 26.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.747 0.784 . . . . 2.5499999999999998 112.899 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' C' ' 40' ' ' ASP . 34.3 t70 -117.07 93.01 4.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.718 -1.128 . . . . 2.29 108.33 177.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' C' ' 39' ' ' ASP . 24.1 t70 72.73 -75.21 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.082 0.864 . . . . 3.0 110.288 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -143.46 7.08 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 3.1400000000000001 110.369 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 42' ' ' LYS . . . . . . . . . . . . . 33.2 mtmm -104.6 126.17 51.42 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.119 -0.491 . . . . 2.96 110.187 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 43' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' D' ' 45' ' ' LEU . 20.8 mt -86.87 106.73 16.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.312 -0.625 . . . . 2.3199999999999998 109.312 179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 44' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.32 127.35 44.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.166 0.508 . . . . 2.27 111.666 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -116.94 106.71 13.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.254 -1.017 . . . . 2.4399999999999999 108.254 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -132.53 172.7 12.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.245 0.545 . . . . 3.02 112.453 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 47' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -65.78 132.12 47.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.124 -0.944 . . . . 2.96 110.129 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 48' ' ' TYR . . . . . 0.551 ' HA ' ' OE1' ' C' ' 35' ' ' GLU . 27.7 p90 -89.12 166.88 13.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.008 -0.542 . . . . 4.2000000000000002 111.115 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -128.08 140.08 37.23 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.245 -0.889 . . . . 3.2400000000000002 109.475 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 50' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.2 129.2 24.75 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.947 2.432 . . . . 3.5 111.524 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -142.62 127.09 17.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.983 0.42 . . . . 3.7200000000000002 110.927 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 52' ' ' MET . . . . . 0.466 ' HB2' ' NE2' ' A' ' 55' ' ' GLN . 2.0 mpt? -87.63 132.03 34.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.945 -0.57 . . . . 6.0099999999999998 110.189 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' C' ' 54' ' ' CYS . 12.0 p -84.54 -150.49 0.12 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.044 -0.525 . . . . 5.6200000000000001 110.851 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 54' ' ' CYS . . . . . 0.419 ' H ' ' HB ' ' C' ' 53' ' ' THR . 60.4 m -69.67 91.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 4.1200000000000001 110.21 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.198 -0.455 . . . . 5.3099999999999996 110.627 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . 0.431 ' O ' HD11 ' D' ' 22' ' ' LEU . 1.9 mpt? . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.924 0.392 . . . . 3.6899999999999999 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -67.82 159.94 29.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.846 0.355 . . . . 3.5699999999999998 110.101 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 3' ' ' SER . . . . . 0.48 ' CB ' HG13 ' C' ' 38' ' ' VAL . 1.6 m -78.37 51.04 0.99 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.141 0.496 . . . . 2.6400000000000001 111.742 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -110.59 28.01 9.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.523 0.678 . . . . 2.4399999999999999 109.749 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.22 44.45 5.02 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.997 -0.841 . . . . 1.9199999999999999 110.997 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mt -114.84 135.95 53.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 121.17 -0.212 . . . . 2.4500000000000002 110.906 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 7' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' C' ' 34' ' ' LEU . 28.8 m -74.17 156.05 6.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.124 0.488 . . . . 2.6099999999999999 112.297 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' D' ' 9' ' ' LYS . 0.0 OUTLIER -155.35 146.42 22.58 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.395 -0.821 . . . . 2.77 110.045 179.336 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 9' ' ' LYS . . . . . 0.436 ' N ' ' HD3' ' D' ' 8' ' ' ARG . 50.8 tttt -63.62 134.2 55.03 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.451 -0.795 . . . . 3.1499999999999999 111.615 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 10' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' C' ' 31' ' ' LYS . 60.6 t -112.15 144.61 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.534 -0.757 . . . . 3.0800000000000001 110.05 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.407 ' HB2' ' OP1' ' F' ' 5' ' ' ' DT' . 3.6 t70 -65.7 156.35 33.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.93 -0.396 . . . . 4.5899999999999999 109.93 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.43 ' HB3' ' HG3' ' C' ' 31' ' ' LYS . 1.9 pt-20 -66.54 -28.39 68.5 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.348 0.499 . . . . 6.0599999999999996 112.348 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 13' ' ' LEU . . . . . 0.413 ' HG ' H5'' ' E' ' 25' ' ' ' DT' . 4.1 mm? -92.19 -53.93 4.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.259 0.552 . . . . 4.8399999999999999 109.6 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.94 1.39 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.815 -0.707 . . . . 3.4300000000000002 112.136 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.534 ' HA ' ' HA ' ' C' ' 17' ' ' VAL . 32.7 mtm180 -74.26 78.23 1.82 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.794 0.33 . . . . 4.5099999999999998 110.347 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 16' ' ' VAL . . . . . 0.543 ' CG1' ' HB ' ' C' ' 16' ' ' VAL . 8.0 p -62.08 138.32 22.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.306 0.574 . . . . 2.75 109.917 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 17' ' ' VAL . . . . . 0.441 HG22 ' NH2' ' C' ' 15' ' ' ARG . 14.0 t -119.47 137.9 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.788 0 CA-C-N 114.848 -1.069 . . . . 3.3599999999999999 112.434 -177.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' HA3' ' C' ' 14' ' ' GLY . 63.4 mt -98.85 110.59 57.98 Favored Pre-proline 0 C--N 1.315 -0.909 0 N-CA-C 105.998 -1.853 . . . . 3.0800000000000001 105.998 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 19' ' ' PRO . . . . . 0.448 ' HB2' ' HB2' ' D' ' 22' ' ' LEU . 81.0 Cg_exo -40.21 151.21 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 124.177 3.251 . . . . 3.46 114.372 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.844 ' HA ' HD11 ' C' ' 13' ' ' LEU . 79.0 mt -47.24 -63.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.144 0 CA-C-N 115.207 -0.906 . . . . 4.8200000000000003 111.002 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -58.71 -41.32 86.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 4.9800000000000004 111.777 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' D' ' 19' ' ' PRO . 0.5 OUTLIER -57.91 -50.67 72.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.639 -0.255 . . . . 3.25 111.213 -179.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -64.41 -33.68 76.42 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.682 0.253 . . . . 2.8799999999999999 111.682 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 24' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' D' ' 20' ' ' ILE . 2.8 mtp180 -72.11 -31.68 66.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.113 0.482 . . . . 6.0999999999999996 109.914 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 25' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' LYS . 59.2 m -76.73 -25.35 53.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.949 -0.569 . . . . 3.73 110.296 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' D' ' 22' ' ' LEU . 84.7 mt -72.29 -43.72 63.83 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.906 -0.405 . . . . 2.9700000000000002 109.906 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.27 65.34 3.52 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.71 -0.677 . . . . 2.79 113.206 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 28' ' ' ILE . . . . . . . . . . . . . 42.2 pt -114.4 -165.39 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 110.069 -0.345 . . . . 2.1499999999999999 110.069 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.924 0.393 . . . . 2.46 110.338 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 30' ' ' GLU . . . . . 0.554 ' OE1' ' HA ' ' C' ' 12' ' ' GLU . 11.0 mm-40 -73.54 -19.73 60.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.194 0.521 . . . . 3.3999999999999999 109.762 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -105.47 27.75 8.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 3.4399999999999999 110.999 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.63 178.8 7.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 2.6600000000000001 110.211 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.95 147.0 24.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 111.025 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 mt -118.62 154.67 32.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.497 -0.319 . . . . 2.1099999999999999 110.691 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 35' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -109.28 109.64 20.61 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.929 -0.767 . . . . 2.3399999999999999 108.929 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 36' ' ' ILE . . . . . . . . . . . . . 20.2 mt -85.1 118.63 32.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.736 -0.665 . . . . 2.3300000000000001 112.383 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 37' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -133.12 165.97 23.52 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.636 -0.875 . . . . 2.2400000000000002 108.636 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 38' ' ' VAL . . . . . . . . . . . . . 13.0 p -123.77 143.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 O-C-N 122.262 -0.274 . . . . 2.1400000000000001 110.273 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' D' ' 42' ' ' LYS . 12.2 t70 -136.78 107.24 6.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.666 -0.243 . . . . 1.99 110.493 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 40' ' ' ASP . . . . . . . . . . . . . 28.7 t70 61.94 -90.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 2.7599999999999998 111.537 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 41' ' ' GLU . . . . . 0.646 ' HA ' HD22 ' C' ' 26' ' ' LEU . 2.5 mt-10 -129.84 14.52 5.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.499 0.19 . . . . 2.3500000000000001 111.382 -179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 42' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' D' ' 39' ' ' ASP . 34.8 pttt -127.2 159.84 33.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.979 0.418 . . . . 2.3399999999999999 111.548 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 43' ' ' ILE . . . . . . . . . . . . . 7.5 mt -97.72 131.21 45.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.72 -0.673 . . . . 1.99 110.097 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mm -108.14 105.04 18.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.055 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 45' ' ' LEU . . . . . 0.519 HD23 HG11 ' C' ' 16' ' ' VAL . 6.3 mp -96.68 91.77 5.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.081 0.467 . . . . 2.77 110.048 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -87.51 -179.24 6.31 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.146 -0.687 . . . . 2.3599999999999999 109.146 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.92 145.35 50.84 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.592 -0.443 . . . . 2.9900000000000002 110.061 178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 48' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.06 179.45 2.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.727 -0.669 . . . . 3.2599999999999998 111.253 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 49' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' D' ' 50' ' ' PRO . 15.0 pttp -102.35 96.55 7.34 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.014 -0.735 . . . . 5.0300000000000002 109.014 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 50' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' D' ' 49' ' ' LYS . 10.3 Cg_endo -53.34 -42.64 63.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.728 2.285 . . . . 3.73 112.561 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 56.42 36.45 27.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.81 0.814 . . . . 4.6200000000000001 109.597 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 52' ' ' MET . . . . . . . . . . . . . 35.3 mtp -89.23 136.68 32.89 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.837 -1.074 . . . . 5.29 110.463 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.1 164.08 24.58 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.754 -0.657 . . . . 5.8300000000000001 110.493 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 54' ' ' CYS . . . . . . . . . . . . . 57.4 m -69.9 103.27 2.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.989 0.423 . . . . 4.5199999999999996 110.21 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 55' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.359 -0.829 . . . . 7.0 110.197 -179.019 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' E' E ' 1' ' ' ' DA' . . . . . 0.668 H2'' ' C6 ' ' E' ' 2' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 O4'-C1'-C2' 107.065 0.878 . . . . 4.0899999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 2' ' ' ' DT' . . . . . 0.668 ' C6 ' H2'' ' E' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 117.089 1.806 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 3' ' ' ' DG' . . . . . 0.769 H2'' ' C8 ' ' E' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.756 0 O3'-P-O5' 100.788 -1.691 . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 4' ' ' ' DA' . . . . . 0.769 ' C8 ' H2'' ' E' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.05 0 O4'-C1'-N19 109.603 2.254 . . . . 4.2300000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 5' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 109.208 1.76 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 6' ' ' ' DT' . . . . . 0.699 H2'' ' C8 ' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 O3'-P-O5' 100.422 -1.883 . . . . 4.2800000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 7' ' ' ' DG' . . . . . 0.699 ' C8 ' H2'' ' E' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 109.458 2.073 . . . . 4.2400000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.523 ' C8 ' H2'' ' E' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 O4'-C1'-N19 109.161 1.702 . . . . 4.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 9' ' ' ' DC' . . . . . 0.674 H2'' ' C8 ' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.433 -0.468 0 O4'-C1'-N19 109.455 2.068 . . . . 3.7799999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 10' ' ' ' DA' . . . . . 0.734 H2'' ' C8 ' ' E' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O3'-P-O5' 100.812 -1.678 . . . . 3.48 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 11' ' ' ' DA' . . . . . 0.734 ' C8 ' H2'' ' E' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 O4'-C1'-N19 109.7 2.375 . . . . 3.2999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 12' ' ' ' DT' . . . . . 0.533 H2'' ' C6 ' ' E' ' 13' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.575 0 O4'-C1'-N19 109.595 2.244 . . . . 3.3399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 13' ' ' ' DT' . . . . . 0.542 " H1'" ' C8 ' ' E' ' 14' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 109.552 2.19 . . . . 3.4399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 14' ' ' ' DA' . . . . . 0.542 ' C8 ' " H1'" ' E' ' 13' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-N19 109.499 2.124 . . . . 3.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.482 ' H72' " C2'" ' E' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.599 -0.653 0 O4'-C1'-N19 109.642 2.303 . . . . 3.6200000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 16' ' ' ' DT' . . . . . 0.554 H2'' ' C8 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O3'-P-O5' 99.832 -2.194 . . . . 3.7000000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 17' ' ' ' DG' . . . . . 0.554 ' C8 ' H2'' ' E' ' 16' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 109.642 2.302 . . . . 3.8399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.601 H2'' ' C8 ' ' E' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O3'-P-O5' 100.211 -1.994 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 19' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.503 0 O4'-C1'-N19 109.38 1.975 . . . . 4.1900000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.664 H2'' ' C8 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-N19 109.233 1.791 . . . . 4.3099999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.664 ' C8 ' H2'' ' E' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 109.497 2.121 . . . . 4.4500000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 22' ' ' ' DC' . . . . . 0.516 H2'' ' C6 ' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O4'-C1'-N19 109.653 2.316 . . . . 4.6200000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 23' ' ' ' DC' . . . . . 0.735 H2'' ' H71' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.6 -0.604 0 O4'-C1'-N19 109.664 2.329 . . . . 4.6699999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 24' ' ' ' DT' . . . . . 0.735 ' H71' H2'' ' E' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.599 -0.659 0 O3'-P-O5' 100.46 -1.863 . . . . 4.6900000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 25' ' ' ' DT' . . . . . 0.614 ' H71' H2'' ' E' ' 24' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.762 0 N19-C1'-C2' 116.142 1.214 . . . . 4.8399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 1' ' ' ' DA' . . . . . 0.724 H2'' ' C8 ' ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C5'-C4'-O4' 108.092 -0.817 . . . . 5.1399999999999997 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 2' ' ' ' DA' . . . . . 0.724 ' C8 ' H2'' ' F' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.893 0 N19-C1'-C2' 116.965 1.728 . . . . 5.2800000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 3' ' ' ' DG' . . . . . 0.591 ' C8 ' " H1'" ' F' ' 2' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.421 -0.788 0 O4'-C1'-N19 109.869 2.586 . . . . 4.9000000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 4' ' ' ' DG' . . . . . 0.416 ' C8 ' " H1'" ' F' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 O4'-C1'-N19 110.071 2.839 . . . . 4.5499999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 5' ' ' ' DT' . . . . . 0.757 H2'' ' H71' ' F' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.598 -0.72 0 O3'-P-O5' 99.352 -2.446 . . . . 4.21 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 6' ' ' ' DT' . . . . . 0.757 ' H71' H2'' ' F' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 O4'-C1'-N19 110.213 3.017 . . . . 4.0300000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 7' ' ' ' DT' . . . . . 0.649 ' OP1' ' HB3' ' C' ' 11' ' ' ASP . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O3'-P-O5' 99.331 -2.458 . . . . 4.0099999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 8' ' ' ' DC' . . . . . 0.521 ' C6 ' H2'' ' F' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O3'-P-O5' 99.153 -2.551 . . . . 4.0199999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 9' ' ' ' DC' . . . . . 0.585 H2'' ' C8 ' ' F' ' 10' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.792 0 O3'-P-O5' 99.506 -2.366 . . . . 3.8500000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 10' ' ' ' DA' . . . . . 0.585 ' C8 ' H2'' ' F' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 O4'-C1'-N19 109.54 2.175 . . . . 3.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 11' ' ' ' DA' . . . . . 0.525 " C2'" ' H72' ' F' ' 12' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O3'-P-O5' 99.554 -2.34 . . . . 3.7200000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 12' ' ' ' DT' . . . . . 0.525 ' H72' " C2'" ' F' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 110.056 2.82 . . . . 3.7999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 13' ' ' ' DA' . . . . . 0.746 " H1'" ' C8 ' ' F' ' 14' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.834 0 O3'-P-O5' 99.4 -2.421 . . . . 3.8599999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 14' ' ' ' DA' . . . . . 0.746 ' C8 ' " H1'" ' F' ' 13' ' ' ' DA' . . . . . . . . 0 P--O3' 1.594 -1.118 0 O4'-C1'-N19 110.236 3.045 . . . . 3.8100000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 15' ' ' ' DT' . . . . . 0.617 H2'' ' C5 ' ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.191 0 O3'-P-O5' 98.987 -2.639 . . . . 3.8700000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 16' ' ' ' DT' . . . . . 0.699 " H1'" ' C8 ' ' F' ' 17' ' ' ' DG' . . . . . . . . 0 P--O3' 1.593 -1.162 0 O3'-P-O5' 99.569 -2.332 . . . . 3.75 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 17' ' ' ' DG' . . . . . 0.699 ' C8 ' " H1'" ' F' ' 16' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.419 -0.949 0 O4'-C1'-N19 109.899 2.624 . . . . 3.5800000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 18' ' ' ' DT' . . . . . 0.482 H2'' ' C6 ' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.594 -1.084 0 O3'-P-O5' 98.892 -2.688 . . . . 3.5299999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 19' ' ' ' DC' . . . . . 0.846 H2'' ' N7 ' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 P--O3' 1.592 -1.28 0 O3'-P-O5' 99.761 -2.231 . . . . 3.4500000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 20' ' ' ' DA' . . . . . 0.846 ' N7 ' H2'' ' F' ' 19' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.866 0 O4'-C1'-N19 109.487 2.108 . . . . 3.4199999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 21' ' ' ' DA' . . . . . 0.658 ' C8 ' H2'' ' F' ' 20' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.872 0 O4'-C1'-N19 109.669 2.336 . . . . 3.8300000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 22' ' ' ' DT' . . . . . 0.723 H2'' ' C5 ' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O3'-P-O5' 100.012 -2.099 . . . . 4.2199999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 23' ' ' ' DC' . . . . . 0.723 ' C5 ' H2'' ' F' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.884 0 N19-C1'-C2' 117.447 2.03 . . . . 4.46 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 24' ' ' ' DA' . . . . . 0.627 ' C8 ' H2'' ' F' ' 23' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.829 0 O3'-P-O5' 101.224 -1.461 . . . . 4.7599999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.712 0 N19-C1'-C2' 116.414 1.384 . . . . 4.96 . . . . . . . . . . 0 0 . 1 stop_ save_