data_2m14_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 2m14 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.446 ' CG ' ' O ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.937 0.399 . . . . 0.0 111.14 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.62 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.418 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.418 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.62 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.419 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.435 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.439 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.579 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.579 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.582 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.422 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.419 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.449 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.836 0.35 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.445 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.479 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.401 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.824 0.345 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.688 0.28 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.42 HG13 ' CE2' ' A' ' 91' ' ' PHE . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.578 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.796 0.331 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.416 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.632 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.401 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.414 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.425 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.416 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.415 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.414 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.488 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.671 0.272 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.474 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.769 0.318 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo . . . . . 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.776 0.322 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.44 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.411 HG13 ' CE2' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.457 ' O ' HG12 ' A' ' 108' ' ' ILE . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.0 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.846 0.355 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.443 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.641 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.428 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.641 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.415 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.422 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.472 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.538 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.41 ' CD1' HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.443 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 3.2 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.779 0.323 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.313 0.577 . . . . 0.0 111.443 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo . . . . . 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.745 0.307 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.418 ' CB ' HG11 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.418 HG11 ' CB ' ' A' ' 93' ' ' ASN . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.448 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.439 HG13 ' CE2' ' A' ' 91' ' ' PHE . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 108' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.442 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.4 mm-40 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.442 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.788 0.327 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.403 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.45 ' CD2' ' CE1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' VAL . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.42 HD13 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.431 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.407 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.72 0.295 . . . . 0.0 110.797 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.467 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.833 0.349 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.435 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 22.6 m-70 . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.71 0.29 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.45 ' CE1' ' CD2' ' A' ' 9' ' ' PHE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.433 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.423 HG13 ' CE2' ' A' ' 91' ' ' PHE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.467 ' O ' HG12 ' A' ' 108' ' ' ILE . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.579 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.579 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.417 ' CG ' HG22 ' A' ' 103' ' ' THR . 14.5 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.432 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.658 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.453 ' CE2' ' CD2' ' A' ' 38' ' ' HIS . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.429 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.432 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.545 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.536 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.429 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.429 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.747 0.308 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.796 0.331 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.677 0.275 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.427 HG13 ' CE2' ' A' ' 91' ' ' PHE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.417 HG22 ' CG ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 108' ' ' ILE . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.1 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.429 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.413 ' CG ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.864 0.364 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.628 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.493 ' CE2' ' CD2' ' A' ' 38' ' ' HIS . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.413 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.628 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.422 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.418 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.485 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 40' ' ' VAL . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.429 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.422 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HG3' ' CH2' ' A' ' 29' ' ' TRP . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.425 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.496 ' CD1' ' HB3' ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' A' ' 61' ' ' ARG . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.728 0.299 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.496 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.745 0.307 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo . . . . . 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 . . . . . 0 N--CA 1.458 -0.043 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.405 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.405 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.413 HG21 ' CG ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.454 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.577 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CG ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' N ' HD12 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.411 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.425 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.576 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.576 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.428 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.42 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 2.8 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.3 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.73 0.3 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.517 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.4 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.832 0.348 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.416 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 25.4 m-70 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.413 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.517 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.415 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.415 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.414 HD12 ' N ' ' A' ' 5' ' ' GLY . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.424 HG21 ' CG ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 104' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.91 0.386 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.432 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.432 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.661 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.488 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.332 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.506 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.738 0.304 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.765 0.317 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.403 ' CB ' HG13 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.439 HG13 ' CE2' ' A' ' 91' ' ' PHE . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.424 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.829 0.347 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.432 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.511 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.462 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 12' ' ' VAL . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.432 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.572 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.572 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.407 ' CB ' ' CG2' ' A' ' 107' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.5 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.782 0.325 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.48 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.776 0.322 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.409 ' CG2' ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD3' ' CG2' ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo . . . . . 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.68 0.276 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.48 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 108' ' ' ILE . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.586 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.586 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CG ' HG23 ' A' ' 103' ' ' THR . 10.4 m80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.892 0.377 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.4 ' CB ' ' CD1' ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 90' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.496 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.496 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.416 ' CB ' HD13 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.461 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.464 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.449 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 15' ' ' ILE . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 27' ' ' LEU . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.506 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.425 ' CD2' ' CB ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.836 0.351 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.424 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.473 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.448 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.45 HG23 HD13 ' A' ' 100' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.427 HG23 ' CG ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' ILE . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.431 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.406 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 103' ' ' THR . 13.4 m80 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.865 0.364 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.429 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.643 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.406 HG12 ' CH2' ' A' ' 29' ' ' TRP . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.643 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.429 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.533 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.533 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CH2' HG12 ' A' ' 12' ' ' VAL . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.411 HD13 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.782 0.325 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.432 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.406 HD13 ' CD1' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.88 0.372 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.797 0.332 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 97' ' ' MET . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.414 HG23 ' CD2' ' A' ' 91' ' ' PHE . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.44 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.436 HD11 HG21 ' A' ' 100' ' ' ILE . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' CG ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.457 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.433 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 104' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.0 m80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.894 0.378 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.441 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.447 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.418 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 12' ' ' VAL . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.447 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.437 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.441 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.572 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.572 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.441 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.424 HG23 ' CD2' ' A' ' 87' ' ' HIS . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.422 ' O ' HD11 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.724 0.297 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.475 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.424 ' CD2' HG23 ' A' ' 40' ' ' VAL . 26.2 m-70 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.82 0.343 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.405 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.439 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 104' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.444 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.892 0.377 . . . . 0.0 111.163 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.409 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.411 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 12' ' ' VAL . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.427 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.44 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.414 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 15' ' ' ILE . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.436 ' CG2' ' CD2' ' A' ' 87' ' ' HIS . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.42 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.449 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.474 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.453 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.474 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.413 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 35.3 Cg_endo . . . . . 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.436 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.3 m-70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.454 ' CD2' ' HA ' ' A' ' 97' ' ' MET . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.414 ' CB ' HG11 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.414 HG11 ' CB ' ' A' ' 93' ' ' ASN . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' CG ' HG22 ' A' ' 103' ' ' THR . 9.2 m80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.916 0.389 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.419 ' CB ' ' CD1' ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.41 HG22 ' N ' ' A' ' 9' ' ' PHE . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.422 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 12' ' ' VAL . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.419 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.577 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.577 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 ' N ' ' O ' ' A' ' 40' ' ' VAL . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.451 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.423 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.911 0.386 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.7 0.286 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.716 0.293 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.431 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.456 HD13 HG23 ' A' ' 100' ' ' ILE . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.418 HG22 ' CG ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.504 ' O ' HG13 ' A' ' 108' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.4 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.925 0.393 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.401 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.457 ' O ' HG11 ' A' ' 12' ' ' VAL . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.425 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.42 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.467 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.467 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.418 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.418 ' HB ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.783 0.325 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.414 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.785 0.326 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.737 0.303 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.429 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.493 ' O ' HG12 ' A' ' 108' ' ' ILE . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.57 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.421 ' CG ' HG23 ' A' ' 103' ' ' THR . 7.9 m80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.4 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 12' ' ' VAL . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.405 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.458 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.428 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.545 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 40' ' ' VAL . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.472 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.414 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.76 0.314 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.853 0.359 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.444 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 84.9 m-70 . . . . . 0 C--O 1.23 0.046 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.406 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.423 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.468 HD11 HG23 ' A' ' 100' ' ' ILE . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.421 HG23 ' CG ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.508 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.424 HG21 ' CE2' ' A' ' 111' ' ' TYR . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.653 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.653 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 29' ' ' TRP . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.567 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.567 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.419 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.405 HD13 ' CD1' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.836 0.35 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.461 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.752 0.31 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.461 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.403 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.45 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.436 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.6 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 104' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.433 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.414 HG22 ' N ' ' A' ' 9' ' ' PHE . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.419 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG11 ' A' ' 12' ' ' VAL . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.426 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.411 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.577 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.577 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.797 0.332 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.1 t0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.78 0.324 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 75' ' ' ASN . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo . . . . . 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.799 0.333 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.417 HG13 ' CE2' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.54 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.57 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.402 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.854 0.359 . . . . 0.0 111.1 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.65 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.417 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.437 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.422 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.298 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.765 0.317 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.765 0.317 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 100' ' ' ILE . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 91' ' ' PHE . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.504 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.452 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.418 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.418 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 15.3 m80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.825 0.345 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.632 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.43 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.472 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.41 ' CG1' HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.401 ' CD1' ' CD2' ' A' ' 104' ' ' LEU . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.807 0.336 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.761 0.315 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.806 0.336 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.439 HG11 ' HB3' ' A' ' 91' ' ' PHE . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.428 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.408 HG12 HG21 ' A' ' 16' ' ' ILE . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.467 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 104' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.812 0.255 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 p -99.48 -68.84 0.79 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.446 ' CG ' ' O ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -83.36 56.89 3.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.62 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.418 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.418 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.62 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.419 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.435 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.439 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.579 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.579 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.582 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.422 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.419 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.449 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.54 133.97 5.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 32.9 p -86.24 99.42 1.03 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.135 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.22 163.73 0.22 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.417 2.745 . . . . 0.0 112.288 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.42 -18.72 7.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.426 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -71.24 -20.98 62.17 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.786 0.327 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -93.29 121.15 34.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.14 -24.13 62.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.109 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -98.38 115.26 28.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.856 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt -91.15 106.12 18.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.906 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.428 ' HB2' ' CZ ' ' B' ' 95' ' ' PHE . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.445 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.479 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.401 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.03 136.67 52.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.555 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.6 p -106.58 -123.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.149 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.555 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 14.3 t0 -171.41 111.01 0.32 Allowed 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -75.57 130.67 12.9 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.66 115.02 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.526 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.4 ptt85 -120.72 153.52 36.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.257 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -107.61 111.14 23.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.395 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.42 HG13 ' CE2' ' A' ' 91' ' ' PHE . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.578 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.47 -49.61 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -56.15 -40.59 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.062 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.87 -48.06 22.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.885 0.374 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.24 15.07 11.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.387 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.79 -30.43 19.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -62.2 -31.08 71.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -113.38 23.94 12.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.118 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.428 ' CZ ' ' HD2' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -169.1 135.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.833 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.43 161.45 13.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -96.07 162.03 13.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 t -135.17 167.19 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 11.1 t -47.27 107.14 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.25 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -91.92 175.85 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -65.63 -156.62 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.499 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -79.48 154.14 29.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.775 0.321 . . . . 0.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -157.14 -52.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.121 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.488 1.182 0 CA-C-O 120.843 0.268 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.2 m -100.92 30.86 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -176.35 48.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.416 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.632 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.401 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.414 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.425 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.416 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.415 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.414 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.488 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.41 132.08 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 3.0 p -56.79 103.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.302 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.6 Cg_endo -48.45 163.75 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.375 2.716 . . . . 0.0 112.316 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.42 -21.74 3.98 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.358 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 p -76.94 -21.47 54.75 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.774 0.321 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m -94.06 99.89 12.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.51 -23.09 57.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.221 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.415 ' N ' ' CD ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -84.67 117.05 23.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.109 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.71 107.69 6.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.102 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' B' ' 95' ' ' PHE . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.474 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 138.43 45.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.538 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 14.5 p -108.95 -124.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.042 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.048 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.538 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 34.4 t0 -178.14 86.14 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.781 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -76.07 150.88 34.22 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -61.05 114.52 3.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.515 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -105.47 114.19 28.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.268 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -93.26 111.27 22.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.386 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.442 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.44 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.411 HG13 ' CE2' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.457 ' O ' HG12 ' A' ' 108' ' ' ILE . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.0 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -67.61 0.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.82 -31.39 68.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.96 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.58 -43.22 69.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.11 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.933 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -90.03 -30.85 17.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.95 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.11 4.13 39.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -58.88 -23.71 61.33 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.633 0.254 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' B' ' 95' ' ' PHE . 0.7 OUTLIER -108.42 -51.58 2.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.987 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.45 ' CE2' ' CE ' ' A' ' 59' ' ' MET . 6.0 m-85 -116.84 175.01 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.831 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 152.89 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.967 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.26 162.0 14.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.911 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.79 116.9 3.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -147.06 -175.36 4.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.848 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.13 -57.54 2.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 150.87 130.32 1.7 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.532 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -83.71 104.02 13.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.343 . . . . 0.0 110.96 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -105.79 -65.46 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.017 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.488 1.195 0 CA-C-O 120.774 0.239 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -106.73 -44.33 4.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 39.56 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.443 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.641 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.428 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.641 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.415 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.422 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.472 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.472 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.538 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.41 ' CD1' HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.443 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 3.2 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.63 141.6 37.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 22.3 p -85.76 99.51 0.99 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.468 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.34 163.76 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.417 2.745 . . . . 0.0 112.382 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.77 -19.19 3.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.524 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.21 -20.68 62.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.311 . . . . 0.0 111.111 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 m -93.13 118.3 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.46 -23.93 63.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.076 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -100.01 115.4 29.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.793 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp -87.08 106.0 17.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.883 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.406 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.19 134.42 36.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.464 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -91.56 -3.89 10.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 122.218 1.008 . . . . 0.0 110.818 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 81.07 -176.86 0.06 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.443 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.402 ' CG1' HG12 ' A' ' 66' ' ' VAL . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.405 ' O ' HG21 ' A' ' 66' ' ' VAL . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.464 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 23.7 Cg_endo -61.12 -166.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.87 172.5 10.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.353 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.88 109.41 2.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.868 0.366 . . . . 0.0 111.444 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 -105.58 111.1 23.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.404 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.418 ' CB ' HG11 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.418 HG11 ' CB ' ' A' ' 93' ' ' ASN . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.448 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.439 HG13 ' CE2' ' A' ' 91' ' ' PHE . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 108' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.442 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.4 mm-40 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.442 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -111.61 -65.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -60.73 -32.47 71.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.74 -37.6 82.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.077 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.887 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.791 0.329 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -89.85 -31.41 17.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.858 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.3 t -68.76 -31.17 70.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.897 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -75.1 -49.18 20.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -75.69 -31.02 59.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.948 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.415 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -132.92 135.01 45.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -100.08 136.45 39.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.931 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -96.03 138.95 32.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.1 161.27 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.832 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 11.7 t -46.99 126.31 8.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.268 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.55 -47.13 7.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.931 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 173.89 -131.89 2.15 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -155.15 31.86 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.839 0.352 . . . . 0.0 110.898 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -141.63 87.56 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.918 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.119 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.488 1.167 0 CA-C-O 121.093 0.372 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.93 -51.82 55.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.927 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 -109.14 42.67 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.921 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.403 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.45 ' CD2' ' CE1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' VAL . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.42 HD13 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.431 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.527 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.407 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.63 131.32 4.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 52' ' ' PRO . 57.6 p -62.51 148.49 90.35 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.378 0.608 . . . . 0.0 110.962 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -85.04 164.33 11.53 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.83 3.02 . . . . 0.0 112.328 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.19 -6.2 8.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.168 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.6 m -90.37 -21.43 21.99 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.794 0.331 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.5 t -96.39 117.6 31.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.883 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -21.25 58.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.104 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.409 ' N ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.67 118.5 23.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.897 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.73 106.06 18.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.797 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.409 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.467 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.425 ' HG3' ' CE1' ' B' ' 95' ' ' PHE . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.86 138.13 58.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.548 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 11.6 p -104.09 -122.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.249 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.548 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 6.6 m-20 -161.18 122.69 2.93 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.848 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.31 139.49 23.55 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 114.98 2.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.508 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -117.61 147.49 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 0.0 111.532 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.435 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 22.6 m-70 -117.08 116.04 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.288 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' CE1' ' CD2' ' A' ' 9' ' ' PHE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.433 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.423 HG13 ' CE2' ' A' ' 91' ' ' PHE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.467 ' O ' HG12 ' A' ' 108' ' ' ILE . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.579 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.579 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.51 -57.01 14.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.65 -31.38 69.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.9 -40.37 47.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.2 t0 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.926 -179.977 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.874 0.369 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -74.45 -31.46 62.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 78.2 p -66.02 -28.8 69.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.013 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -58.45 -39.88 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.989 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -100.98 -34.48 9.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.865 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.425 ' CE1' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -99.34 139.01 35.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.843 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -94.05 163.18 13.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.994 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -96.06 162.0 13.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 4.0 t -135.2 164.45 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.836 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 11.7 t -46.95 112.16 0.48 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.31 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -134.55 -48.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.58 -29.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.515 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.8 t30 61.02 157.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.797 0.332 . . . . 0.0 110.913 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -168.56 -46.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.881 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.133 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.162 0 CA-C-O 120.841 0.267 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 p -75.77 -31.59 59.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.928 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.417 ' CG ' HG22 ' A' ' 103' ' ' THR . 14.5 m80 -98.24 38.49 1.32 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.432 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.658 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.453 ' CE2' ' CD2' ' A' ' 38' ' ' HIS . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.429 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.429 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.432 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.545 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.536 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.429 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.536 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.429 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.33 132.55 29.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -51.28 101.79 0.28 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.43 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -47.46 163.91 0.16 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.439 2.759 . . . . 0.0 112.171 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -49.43 -22.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.482 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -73.48 -21.53 60.4 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.761 0.315 . . . . 0.0 111.136 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.0 m -97.34 115.17 27.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.843 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -77.43 -16.94 58.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.499 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.504 ' H ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 123.27 29.71 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 120.754 0.311 . . . . 0.0 111.168 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.37 106.08 5.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.669 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -56.42 143.95 32.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.546 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.8 p -105.75 -123.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.094 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.546 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 3.5 p30 -172.25 120.01 0.42 Allowed 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.93 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.76 142.27 47.47 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -61.99 116.29 4.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.2 ptt-85 -125.91 160.7 29.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.214 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -114.39 151.22 33.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.659 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.427 HG13 ' CE2' ' A' ' 91' ' ' PHE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.417 HG22 ' CG ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 108' ' ' ILE . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.1 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.429 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm -60.24 -58.68 7.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.39 -31.29 69.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.68 -34.5 58.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.833 -179.938 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.825 0.345 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -74.16 -48.43 29.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.1 -31.24 23.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -59.9 -31.38 69.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.994 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.05 -31.57 72.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.04 135.04 33.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.816 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -114.31 152.64 31.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -86.08 161.96 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.99 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 t -136.01 107.05 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.02 134.02 20.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.859 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 64.64 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -168.73 -150.55 6.72 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.456 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 60.4 86.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 110.92 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -125.79 84.91 2.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.893 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.118 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.167 0.403 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -56.76 4.25 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.941 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.413 ' CG ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 -97.75 38.81 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.628 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.493 ' CE2' ' CD2' ' A' ' 38' ' ' HIS . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.413 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.628 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.422 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.418 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.485 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 40' ' ' VAL . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.429 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.422 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HG3' ' CH2' ' A' ' 29' ' ' TRP . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.425 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.496 ' CD1' ' HB3' ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' A' ' 61' ' ' ARG . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.49 132.8 5.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 20.4 p -85.88 99.59 1.04 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.58 163.74 0.17 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.425 2.75 . . . . 0.0 112.292 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.3 -17.2 7.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.512 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 m -71.24 -21.39 62.12 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.781 0.324 . . . . 0.0 111.222 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -88.4 124.16 33.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.899 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -60.67 -29.3 69.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.979 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.07 121.68 43.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.838 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp -90.42 105.91 18.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.092 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.435 ' HE1' ' CE1' ' B' ' 95' ' ' PHE . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.496 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.72 137.97 37.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.551 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 13.8 p -112.78 -126.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.074 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.551 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 0.6 OUTLIER -179.87 106.57 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.707 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HB2' ' CG2' ' A' ' 66' ' ' VAL . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -79.29 178.92 6.89 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -78.4 165.61 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.339 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 33.4 mtt-85 -151.79 109.32 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 0.0 111.501 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.6 111.09 22.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.081 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.405 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.405 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.413 HG21 ' CG ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.454 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.577 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.7 -66.83 0.38 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -58.69 -31.44 68.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.64 -62.74 1.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.169 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.886 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.855 0.36 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.49 -39.66 37.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 58.7 m -60.17 -34.46 73.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.88 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -31.16 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.37 -62.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CE1' ' HE1' ' A' ' 59' ' ' MET . 1.6 m-85 -83.15 158.21 22.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.734 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.97 148.69 21.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.08 162.08 13.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 9.7 t -126.52 163.98 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.847 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 11.4 t -46.85 138.9 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.898 0.38 . . . . 0.0 111.252 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.94 -172.38 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.865 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -95.07 -62.28 1.01 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.482 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -160.3 -176.83 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -131.95 -46.57 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 10.0 p . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.12 179.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 N--CA 1.489 1.21 0 CA-C-O 120.881 0.284 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m -84.45 2.92 38.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.409 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CG ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 60.78 38.45 18.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' N ' HD12 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.411 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.425 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.576 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.576 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.428 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.42 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 2.8 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.53 132.56 5.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.456 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 p -84.78 99.6 0.88 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.12 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.41 163.75 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 123.486 2.791 . . . . 0.0 112.328 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.76 -17.73 6.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.519 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -71.17 -21.15 62.21 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -90.97 123.6 34.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.871 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.21 -24.58 63.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -99.69 135.34 41.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.84 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.3 mtp -105.74 105.94 16.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.409 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.517 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.4 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.09 143.51 48.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.559 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.6 p -111.28 -126.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.027 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.559 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 0.8 OUTLIER -142.47 -175.88 4.63 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.918 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -68.02 130.15 20.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -63.11 114.72 3.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.437 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.22 161.93 18.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.293 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.416 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 25.4 m-70 -115.51 124.76 51.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.6 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.413 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.517 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.415 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.415 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.414 HD12 ' N ' ' A' ' 5' ' ' GLY . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.424 HG21 ' CG ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 104' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -63.82 1.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.52 -30.92 67.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -65.42 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.149 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.857 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -88.8 -44.84 10.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -28.62 68.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.058 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -31.88 66.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.034 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -59.77 4.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.856 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.409 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -79.06 134.97 36.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.76 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.9 165.16 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.016 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -96.08 162.05 13.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 10.7 p -127.79 130.54 70.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.132 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.06 99.12 3.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.33 150.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.911 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -142.53 -159.73 8.06 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -131.27 139.29 49.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -136.46 119.71 16.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.169 179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.488 1.186 0 CA-C-O 120.827 0.261 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -109.28 -28.3 9.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -151.71 49.67 0.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.791 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.432 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.432 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.661 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.42 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.488 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.63 152.32 48.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.442 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 47.6 p -86.94 99.41 1.13 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -48.75 163.69 0.27 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.471 2.78 . . . . 0.0 112.3 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.51 -17.82 15.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.404 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.2 m -71.36 -21.16 62.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -95.48 121.89 37.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.83 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.94 -22.84 50.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.198 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.17 116.99 29.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp -96.22 106.2 18.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.405 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.506 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -56.42 148.66 18.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.582 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 7.1 p -97.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.753 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.582 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 4.7 t0 76.77 -179.3 0.14 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.347 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.06 146.45 87.26 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -60.15 121.87 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.566 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.05 159.14 35.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.217 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -111.66 120.74 43.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.551 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.403 ' CB ' HG13 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.439 HG13 ' CE2' ' A' ' 91' ' ' PHE . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.465 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.424 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -68.13 0.24 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.42 -30.74 68.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.963 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.09 -59.46 3.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.935 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . 0.42 ' CD1' ' N ' ' B' ' 91' ' ' ASP . 50.3 p90 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.779 0.324 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . 0.42 ' N ' ' CD1' ' B' ' 90' ' ' TYR . 9.1 t0 -89.89 -69.6 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 95.2 p -110.26 -31.85 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.952 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -60.83 -29.12 69.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -84.04 -30.05 26.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.43 ' CD2' ' CG2' ' A' ' 51' ' ' THR . 1.2 t80 -167.53 135.0 2.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.97 131.54 54.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.99 145.93 25.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t -96.27 166.12 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.732 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 13.2 t -47.0 161.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.869 0.366 . . . . 0.0 111.265 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -127.79 -48.02 1.38 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 155.64 68.29 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.43 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -115.56 109.51 17.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -109.31 34.38 3.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.937 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.071 -179.989 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.489 1.211 0 CA-C-O 120.948 0.312 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.8 p -114.85 -48.2 2.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -115.51 40.39 2.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.432 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.511 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.462 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 12' ' ' VAL . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.432 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.572 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.572 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.407 ' CB ' ' CG2' ' A' ' 107' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.5 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.42 131.99 16.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.426 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 1.0 OUTLIER -59.81 103.71 0.39 Allowed Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.29 163.68 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.435 2.756 . . . . 0.0 112.275 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.61 -19.13 9.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.361 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -21.39 50.46 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.5 m -90.17 114.66 26.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.984 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.6 -23.22 66.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.116 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.72 127.9 36.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp -94.15 105.92 17.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.428 ' CE ' ' CE1' ' B' ' 95' ' ' PHE . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.48 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -85.76 141.57 29.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.462 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -77.85 -8.64 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-O 121.996 0.903 . . . . 0.0 111.296 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 60.69 -175.06 0.12 Allowed 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.755 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.409 ' CG2' ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD3' ' CG2' ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 88.8 Cg_endo -81.81 140.95 11.81 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.81 115.52 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.3 162.47 29.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.925 0.393 . . . . 0.0 111.456 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -116.69 151.25 36.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.522 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.48 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 108' ' ' ILE . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.586 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.586 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -70.9 -59.8 2.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -57.96 -31.2 66.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.9 64.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.92 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.736 0.303 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.95 -31.3 17.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.934 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.2 t -96.45 -31.17 12.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -60.12 -31.5 70.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.901 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -88.41 -62.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.428 ' CE1' ' CE ' ' A' ' 59' ' ' MET . 5.4 m-85 -78.77 135.03 36.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.708 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.83 154.87 18.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -90.31 162.02 15.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.0 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.23 111.2 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.03 -177.52 5.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -154.93 77.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.63 103.41 2.54 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.61 172.58 11.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.786 0.327 . . . . 0.0 110.924 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.11 84.69 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.113 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.199 0 CA-C-O 120.946 0.311 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 t -95.39 -43.38 8.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CG ' HG23 ' A' ' 103' ' ' THR . 10.4 m80 -105.64 38.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.935 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' CB ' ' CD1' ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 90' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.496 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.496 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.416 ' CB ' HD13 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.461 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.464 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.449 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 15' ' ' ILE . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 27' ' ' LEU . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.506 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.425 ' CD2' ' CB ' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.02 132.47 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.488 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 41.3 p -88.1 99.27 1.29 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.059 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.47 163.73 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 123.4 2.733 . . . . 0.0 112.37 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.87 -15.73 14.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.428 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.2 -21.43 62.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.749 0.309 . . . . 0.0 111.174 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 m -92.92 125.67 37.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.836 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.98 -25.61 63.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.01 115.15 29.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp -95.27 106.06 18.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.78 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.447 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -77.87 137.26 38.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.561 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.0 p -105.0 -123.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.106 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.561 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 3.8 m-20 -177.44 119.95 0.11 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.82 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.88 -176.31 2.78 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -80.04 115.36 19.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -106.62 116.36 31.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.508 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -93.15 111.7 23.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.424 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.473 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.448 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.45 HG23 HD13 ' A' ' 100' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.427 HG23 ' CG ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' ILE . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.431 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.406 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -55.7 -67.01 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -31.31 69.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.926 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.58 -43.02 77.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.085 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.872 -179.97 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.852 0.358 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.02 -31.57 70.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -34.72 76.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.23 28.79 8.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -119.99 -41.87 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.904 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.447 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 1.6 m-85 -94.49 144.19 25.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -93.94 149.6 21.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -96.1 150.07 20.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.174 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 34.3 t -99.99 163.96 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.636 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 14.5 t -46.67 146.17 1.64 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.844 0.355 . . . . 0.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -151.71 -174.01 4.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.9 170.98 44.49 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.57 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -141.67 76.06 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.68 147.02 46.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.121 179.975 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.192 0 CA-C-O 120.887 0.286 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -95.93 -30.67 13.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 103' ' ' THR . 13.4 m80 -97.38 38.84 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.429 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.643 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.406 HG12 ' CH2' ' A' ' 29' ' ' TRP . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.643 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.533 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.533 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CH2' HG12 ' A' ' 12' ' ' VAL . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.456 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.411 HD13 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.8 131.45 13.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.4 p -54.24 102.79 0.33 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.307 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -47.6 163.76 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.417 2.745 . . . . 0.0 112.334 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.92 -17.6 6.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.516 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -71.2 -21.09 62.19 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.747 0.308 . . . . 0.0 111.13 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.32 130.17 54.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.797 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.36 -19.82 52.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.411 ' N ' ' CD ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.85 117.75 23.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.082 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.99 111.95 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.769 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.442 ' CE ' ' CE1' ' B' ' 95' ' ' PHE . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.432 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.406 HD13 ' CD1' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 141.02 49.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.554 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 13.2 p -106.51 -123.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.149 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.554 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 1.7 p30 -176.32 132.46 0.23 Allowed 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -75.68 -168.47 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -86.31 115.62 23.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.644 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -100.48 110.18 22.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -93.27 113.38 25.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.547 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 97' ' ' MET . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.414 HG23 ' CD2' ' A' ' 91' ' ' PHE . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.44 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.436 HD11 HG21 ' A' ' 100' ' ' ILE . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' CG ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.457 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.433 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 104' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -53.21 60.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.23 -31.72 71.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.31 -61.16 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.886 -179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . 0.401 ' CE1' ' OD2' ' B' ' 91' ' ' ASP . 30.3 p90 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.771 0.32 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . 0.401 ' OD2' ' CE1' ' B' ' 90' ' ' TYR . 10.4 m-20 -67.17 -31.51 71.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 13.2 p -63.77 -37.91 89.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -77.32 -31.12 54.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.953 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.93 -31.46 72.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.442 ' CE1' ' CE ' ' A' ' 59' ' ' MET . 13.2 m-85 -142.41 134.92 27.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.858 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -102.89 168.62 9.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.004 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -96.07 162.06 13.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 35.6 m -108.43 115.13 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.11 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.68 133.04 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -78.06 -170.71 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -158.0 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -147.25 156.0 42.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 110.921 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 60.91 156.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.126 -179.96 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.488 1.174 0 CA-C-O 120.806 0.252 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -104.1 -54.58 2.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -98.35 38.72 1.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.441 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.447 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.418 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 12' ' ' VAL . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.447 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.437 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.441 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.572 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.572 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.441 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.424 HG23 ' CD2' ' A' ' 87' ' ' HIS . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.424 HD11 HG22 ' B' ' 98' ' ' VAL . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.56 132.02 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 p -88.08 99.42 1.36 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.092 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -48.18 163.64 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.377 2.718 . . . . 0.0 112.284 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -17.29 8.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.511 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.08 -20.86 62.31 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.796 0.331 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.82 128.91 37.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.73 -26.87 68.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.061 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -100.17 115.36 29.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.695 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp -92.68 105.83 17.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.913 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.475 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -68.36 138.83 55.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.554 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 14.3 p -108.73 -124.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.034 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.554 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 7.2 t70 -173.71 149.59 1.62 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.888 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.44 130.66 12.02 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -57.21 114.5 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.519 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.58 153.87 46.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.275 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.424 ' CD2' HG23 ' A' ' 40' ' ' VAL . 26.2 m-70 -110.6 116.75 31.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.483 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.405 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.439 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 104' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.444 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -60.35 -50.59 73.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -60.37 -31.73 70.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.67 -34.58 60.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.863 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.794 0.331 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.62 -51.01 9.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.904 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -78.11 -31.26 49.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.9 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.45 29.06 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.86 -63.01 1.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.922 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.448 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 54.8 m-85 -84.66 137.55 33.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.861 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -93.92 157.13 16.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.014 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -95.94 162.05 13.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . 0.424 HG22 HD11 ' A' ' 48' ' ' LEU . 34.2 m -107.21 116.87 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.03 162.41 38.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.39 118.43 6.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.948 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.66 -62.69 0.38 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 62.83 -79.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.739 0.304 . . . . 0.0 111.025 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -154.11 -74.4 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.963 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 27.6 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.041 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.485 1.027 0 CA-C-O 120.989 0.329 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 t -70.04 -68.87 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.892 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -86.53 53.89 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.163 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.409 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.411 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 12' ' ' VAL . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.427 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.44 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.414 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 15' ' ' ILE . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.436 ' CG2' ' CD2' ' A' ' 87' ' ' HIS . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.42 ' O ' ' CE2' ' A' ' 111' ' ' TYR . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.449 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.474 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -153.53 134.39 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.34 149.2 49.83 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.218 0.532 . . . . 0.0 111.169 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -84.97 164.32 11.64 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.882 3.055 . . . . 0.0 112.222 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.2 -6.66 4.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.153 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -90.92 -21.47 21.35 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.764 0.316 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.0 t -84.28 129.48 34.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.44 -24.92 60.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.104 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -102.28 114.39 28.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.49 118.31 21.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.453 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.474 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.76 131.04 57.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.459 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -86.99 -5.4 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 122.261 1.029 . . . . 0.0 110.7 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 42.21 29.9 0.17 Allowed 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.619 -1.628 . . . . 0.0 112.062 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.459 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 35.3 Cg_endo -63.41 167.68 12.6 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.99 114.98 4.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.353 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -104.25 115.85 31.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.303 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.436 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.3 m-70 -103.18 111.17 23.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.454 ' CD2' ' HA ' ' A' ' 97' ' ' MET . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.414 ' CB ' HG11 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.414 HG11 ' CB ' ' A' ' 93' ' ' ASN . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp -58.73 -44.18 90.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -31.21 69.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.08 -34.38 16.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.162 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.948 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.731 0.301 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -89.67 -31.71 17.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 3.8 m -87.23 -31.34 20.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -98.42 28.99 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -88.3 -33.71 17.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.873 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.18 137.64 40.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.91 166.64 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -96.01 161.97 13.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.016 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 t -137.91 163.45 29.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 11.0 t -47.46 127.86 11.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.185 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.26 -54.38 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -156.72 108.03 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -60.49 145.64 47.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.845 0.355 . . . . 0.0 110.92 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -169.66 164.48 10.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.114 179.968 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.487 1.141 0 CA-C-O 120.841 0.267 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -116.77 -52.5 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' CG ' HG22 ' A' ' 103' ' ' THR . 9.2 m80 -105.65 38.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' CB ' ' CD1' ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.41 HG22 ' N ' ' A' ' 9' ' ' PHE . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.422 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 12' ' ' VAL . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.419 ' CD1' ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.577 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.577 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 ' N ' ' O ' ' A' ' 40' ' ' VAL . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.451 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.423 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.72 134.76 23.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.446 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 8.9 p -44.59 99.59 0.21 Allowed Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.597 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -48.72 163.65 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 123.455 2.77 . . . . 0.0 112.208 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.83 -18.37 12.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.402 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -81.84 -21.37 37.63 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.738 0.304 . . . . 0.0 111.187 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -86.82 136.95 32.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -89.36 -19.53 25.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.4 ' N ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 167.15 17.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.86 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp -122.5 105.77 10.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.72 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.22 138.34 33.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.428 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -104.15 -8.16 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 CA-C-O 122.073 0.94 . . . . 0.0 111.276 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 62.93 131.82 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.715 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.428 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 73.4 Cg_endo -74.11 128.19 12.0 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -58.19 115.0 2.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.379 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -129.08 160.56 32.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.128 0.489 . . . . 0.0 111.618 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 -125.43 128.85 48.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.304 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.431 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.456 HD13 HG23 ' A' ' 100' ' ' ILE . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.418 HG22 ' CG ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.504 ' O ' HG13 ' A' ' 108' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.4 ' O ' ' HB3' ' A' ' 110' ' ' ARG . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.9 -67.32 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -37.71 88.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.915 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.55 -36.09 82.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.12 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.4 t0 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.883 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.824 0.345 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.29 -67.95 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -96.96 -63.76 1.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.842 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.96 -66.81 0.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -120.04 -42.12 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -168.97 170.56 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.814 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.92 146.24 24.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.056 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -91.4 162.07 14.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 34.4 t -128.94 103.96 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.094 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.01 101.99 3.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -156.81 -50.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.61 64.84 3.65 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.487 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.6 t30 59.94 84.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.811 0.339 . . . . 0.0 110.94 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 64.86 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.872 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.099 -179.983 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.895 0.29 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -108.91 -29.7 8.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.974 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -161.2 48.56 0.22 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.933 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.401 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.457 ' O ' HG11 ' A' ' 12' ' ' VAL . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.425 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.42 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.467 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.467 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.418 ' HB3' ' HB ' ' A' ' 40' ' ' VAL . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.418 ' HB ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' HB3' ' CE1' ' B' ' 95' ' ' PHE . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.99 145.53 39.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.505 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -77.65 102.27 0.86 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.094 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.09 163.62 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.433 2.756 . . . . 0.0 112.334 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.72 -14.12 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.407 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 t -86.26 -18.49 31.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.752 0.31 . . . . 0.0 111.2 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.406 ' OG ' ' HG2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -74.95 133.5 41.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.875 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -71.6 -31.4 66.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.891 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -102.5 140.17 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.721 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp -101.55 105.94 16.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.803 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.4 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HG3' ' CZ ' ' B' ' 95' ' ' PHE . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp -60.65 139.56 57.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.552 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 13.7 p -106.29 -124.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.147 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.552 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 4.9 t0 -179.4 145.6 0.25 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.92 -178.31 2.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -81.12 115.08 20.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.384 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -107.48 116.7 32.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.436 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -93.23 116.95 29.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.187 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.429 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.493 ' O ' HG12 ' A' ' 108' ' ' ILE . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.57 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -69.83 -63.06 1.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.24 -31.67 70.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.2 -61.35 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.113 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.5 t0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.879 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . 0.403 ' CE2' ' OG ' ' B' ' 92' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.135 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.31 -40.11 89.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.403 ' OG ' ' CE2' ' B' ' 90' ' ' TYR . 0.3 OUTLIER -60.38 -32.43 71.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 28.98 7.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -119.9 25.03 10.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.427 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -168.93 134.98 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.871 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.37 164.54 27.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -95.99 161.83 13.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.937 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 10.8 p -141.65 115.39 4.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.73 178.92 7.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.914 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -132.87 172.42 12.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 159.1 -103.35 0.23 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.557 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 60.54 34.84 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.944 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.07 -61.46 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.157 -0.925 . . . . 0.0 111.073 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.179 0 CA-C-O 120.859 0.275 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -103.26 -48.35 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.421 ' CG ' HG23 ' A' ' 103' ' ' THR . 7.9 m80 -98.03 37.87 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 12' ' ' VAL . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.405 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.458 ' N ' ' O ' ' A' ' 30' ' ' ARG . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.428 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.545 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 40' ' ' VAL . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.472 ' HG ' ' N ' ' A' ' 49' ' ' GLN . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.472 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.5 138.01 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.431 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 12.0 p -84.94 99.57 0.89 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.134 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -48.2 163.67 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.401 2.734 . . . . 0.0 112.295 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.66 -13.89 26.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.471 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -71.24 -21.52 62.1 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.741 0.305 . . . . 0.0 111.212 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -92.59 129.24 38.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.26 -28.29 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.94 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -95.43 159.53 14.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.658 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.414 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp -130.13 105.69 8.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.165 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' CE2' ' B' ' 95' ' ' PHE . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.69 141.89 53.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.568 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 14.9 p -106.81 -124.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.153 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.568 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 9.2 t0 -164.52 107.68 0.9 Allowed 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.819 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.84 -176.86 1.65 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -73.65 114.8 12.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -108.13 114.9 29.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.478 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.444 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 84.9 m-70 -93.36 111.25 22.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.049 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.406 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.423 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.468 HD11 HG23 ' A' ' 100' ' ' ILE . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.421 HG23 ' CG ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.508 ' O ' HG13 ' A' ' 108' ' ' ILE . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.424 HG21 ' CE2' ' A' ' 111' ' ' TYR . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -67.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.55 -31.6 69.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.47 -33.72 71.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.942 179.928 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.86 -30.68 40.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -59.43 -29.25 67.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -58.94 -55.71 31.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.26 -63.11 1.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -72.88 135.07 45.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.822 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -118.63 141.45 48.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.0 162.05 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.01 108.14 18.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.147 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.05 -176.26 5.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.59 81.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -137.45 -88.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.466 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.4 t30 60.71 172.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -167.48 146.23 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.924 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.098 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.815 0.256 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -105.65 -30.82 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -149.34 47.5 0.97 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.831 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB3' ' HB ' ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.653 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.653 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 29' ' ' TRP . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.567 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.567 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.419 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.405 HD13 ' CD1' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -149.08 131.33 15.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.441 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 2.8 p -57.87 103.38 0.36 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.197 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.39 163.72 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.334 2.689 . . . . 0.0 112.295 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.75 -18.32 12.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.383 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -74.77 -21.43 59.33 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.765 0.317 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.9 t -102.11 108.64 20.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.919 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -59.1 -21.34 59.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 mmmt -84.04 115.1 22.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.85 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp -80.87 117.04 21.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.832 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.446 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.461 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 142.25 58.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.55 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 13.0 p -107.0 -124.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.994 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.55 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 3.0 p30 -176.7 141.93 0.4 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.916 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.12 167.92 25.03 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.18 175.95 0.37 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.535 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -166.97 109.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.861 0.362 . . . . 0.0 111.287 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -93.03 122.24 35.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.336 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.461 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.403 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.45 ' O ' HG13 ' A' ' 108' ' ' ILE . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.436 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.6 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 104' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -64.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.966 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.51 -39.41 64.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.136 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.915 179.966 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.761 0.315 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -60.35 -31.77 70.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.5 t -98.17 3.96 49.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.415 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -98.69 29.06 3.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.09 -56.24 5.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.867 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.446 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 3.2 m-85 -82.35 135.01 35.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.785 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -108.93 159.24 16.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.045 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -96.03 161.98 13.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.938 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 35.9 m -121.65 111.91 32.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 157.12 43.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.925 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -109.9 -48.14 3.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.45 143.2 0.47 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -139.88 107.21 5.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -107.97 141.32 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.915 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.151 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 120.839 0.266 . . . . 0.0 111.768 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -67.57 -39.89 84.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.433 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -92.39 46.79 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.141 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.414 HG22 ' N ' ' A' ' 9' ' ' PHE . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.419 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG11 ' A' ' 12' ' ' VAL . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.426 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.411 ' HB ' ' HB2' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.577 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.577 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 40' ' ' VAL . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.539 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.56 132.16 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.473 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -54.13 102.55 0.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.359 -179.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.6 Cg_endo -48.51 163.66 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 123.359 2.706 . . . . 0.0 112.264 178.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.41 -14.34 27.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.426 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.39 -21.45 45.67 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.731 0.301 . . . . 0.0 111.257 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 m -95.52 127.19 41.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.96 63.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.82 140.27 32.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.827 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm -108.72 105.97 15.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.901 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HG3' ' CZ ' ' B' ' 95' ' ' PHE . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 138.49 58.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.545 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.2 p -105.02 -123.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.131 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.545 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 6.1 t0 -179.94 104.09 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 75' ' ' ASN . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.76 -172.78 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -86.88 115.06 24.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.613 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -107.44 109.46 21.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.268 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -94.14 114.04 26.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.417 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.417 HG13 ' CE2' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.54 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.57 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt -134.0 -66.11 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -31.84 72.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.86 -52.87 31.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.928 -179.988 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.341 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -90.2 15.04 11.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.6 m -98.62 -31.34 11.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.81 0.338 . . . . 0.0 110.919 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.67 -60.13 4.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.05 -49.79 40.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.955 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.415 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -101.1 135.09 43.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.881 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -139.9 138.07 35.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.911 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -74.88 155.12 37.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.9 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . 0.405 ' CG2' HD22 ' A' ' 48' ' ' LEU . 27.1 m -135.43 109.18 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.08 126.14 12.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.9 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -100.8 -169.94 1.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -171.43 -103.87 0.17 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.472 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -174.65 79.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.81 0.338 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.16 142.28 31.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.067 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.487 1.129 0 CA-C-O 120.914 0.298 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -67.79 -67.21 0.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.966 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.402 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -89.3 50.62 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.1 -179.962 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.437 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.65 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.417 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.437 ' HB ' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.571 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.571 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 40' ' ' VAL . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.422 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.57 131.76 12.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.484 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 1.2 p -58.07 103.6 0.37 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.484 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -47.82 163.73 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 123.304 2.669 . . . . 0.0 112.358 179.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.43 -20.2 4.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.446 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.4 p -76.58 -21.29 55.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.8 m -92.8 115.28 27.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.13 -22.19 64.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.1 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 mmmt -88.6 114.8 25.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.884 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.7 106.24 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' NE ' ' CD2' ' B' ' 95' ' ' PHE . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.14 142.59 58.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.561 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 12.1 p -104.86 -123.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 CA-C-O 120.984 0.421 . . . . 0.0 110.054 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.561 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 1.4 m-20 -145.62 101.8 3.61 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.877 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -74.13 140.88 28.65 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -64.13 115.33 4.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.483 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.5 ptt85 -124.69 174.87 7.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.219 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 -130.65 126.91 37.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.676 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 100' ' ' ILE . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 91' ' ' PHE . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.504 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.452 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.418 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.418 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -70.98 -54.55 10.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.97 -31.49 68.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.953 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.63 -30.46 36.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.893 179.985 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.782 0.325 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -68.42 -30.94 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.64 -30.43 68.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.918 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.06 -30.73 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -76.77 -31.32 56.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CD2' ' NE ' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -95.28 134.98 37.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -102.16 162.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.94 162.04 13.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 32.3 t -132.8 103.87 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.086 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.16 107.4 4.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.909 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.43 165.76 4.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 109.62 -104.05 1.83 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.532 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.68 166.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.852 0.358 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -132.73 123.03 25.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.161 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 120.823 0.259 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.03 -49.39 3.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -97.88 38.44 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.632 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.43 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' ARG . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.43 ' O ' ' N ' ' A' ' 5' ' ' GLY . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.472 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.472 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' ' O ' ' A' ' 24' ' ' PRO . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.41 ' CG1' HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.401 ' CD1' ' CD2' ' A' ' 104' ' ' LEU . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.22 134.8 17.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.4 p -84.31 99.57 0.83 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.037 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -47.38 163.8 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.378 2.719 . . . . 0.0 112.353 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.04 -18.1 4.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.483 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -71.29 -21.03 62.13 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.778 0.323 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -94.33 117.69 30.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.811 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -58.25 -22.86 53.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -99.0 115.03 28.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp -87.52 106.1 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.811 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.404 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.02 140.33 52.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.56 ' CG1' ' H ' ' A' ' 67' ' ' ASP . 15.0 p -109.17 -125.15 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.156 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.56 ' H ' ' CG1' ' A' ' 66' ' ' VAL . 7.0 p-10 -178.38 -175.03 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.758 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.95 122.87 7.5 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -56.95 114.91 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -128.53 166.68 18.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -127.25 131.0 50.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.499 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.402 ' CB ' ' CG1' ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.439 HG11 ' HB3' ' A' ' 91' ' ' PHE . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.428 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.408 HG12 HG21 ' A' ' 16' ' ' ILE . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 106' ' ' GLN . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 108' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.467 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 104' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -73.62 -61.07 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.98 -38.64 83.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.82 -68.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.106 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.4 t70 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.223 179.818 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.858 0.361 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -76.01 -32.35 59.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -63.82 -31.54 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.03 -32.24 73.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.04 -40.21 11.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.404 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -88.64 134.99 33.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.832 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -137.04 166.02 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.907 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.02 162.02 13.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 7.8 p -132.96 107.3 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.04 102.01 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.858 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -81.18 102.87 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.3 -156.93 21.63 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.477 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -121.08 105.11 10.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.775 0.321 . . . . 0.0 110.881 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -84.11 159.41 21.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.06 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.892 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.937 0.399 . . . . 0.0 111.14 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.833 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.833 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.647 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.433 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.716 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.599 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.872 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.805 ' HD2' HG11 ' A' ' 12' ' ' VAL . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.538 HG12 ' H ' ' A' ' 43' ' ' SER . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HG13 ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.538 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 1.031 HD12 ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.837 ' HE2' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.661 ' CD1' HD23 ' A' ' 104' ' ' LEU . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.836 0.35 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.595 HD13 ' CD1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.031 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.837 HG21 ' HE2' ' A' ' 47' ' ' LYS . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.824 0.345 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.516 ' O ' HG13 ' A' ' 80' ' ' VAL . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.401 ' NE2' HG22 ' A' ' 40' ' ' VAL . 4.8 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.688 0.28 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.448 ' HE3' ' CZ ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.573 ' O ' HD12 ' A' ' 8' ' ' ILE . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.595 ' CD1' HD13 ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.571 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.571 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.613 HG23 HD13 ' A' ' 104' ' ' LEU . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.892 HG21 ' HA ' ' A' ' 3' ' ' HIS . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.872 HD11 ' CD1' ' A' ' 27' ' ' LEU . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.584 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 42' ' ' LEU . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.584 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.936 ' HA ' HG21 ' A' ' 103' ' ' THR . 5.7 p-80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.796 0.331 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.431 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.664 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.861 ' O ' HG12 ' A' ' 12' ' ' VAL . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.443 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.861 HG12 ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.664 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.634 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.736 HG21 ' HG3' ' A' ' 26' ' ' GLU . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.445 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.613 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HG3' HG21 ' A' ' 22' ' ' VAL . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.58 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.772 ' CD ' HG11 ' A' ' 12' ' ' VAL . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.815 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.815 HD11 HG13 ' A' ' 40' ' ' VAL . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.434 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.428 ' HB3' ' HB2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.671 0.272 . . . . 0.0 111.102 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 60' ' ' LEU . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.733 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.769 0.318 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.447 ' O ' HG13 ' A' ' 80' ' ' VAL . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' ASN . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo . . . . . 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.776 0.322 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.534 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.733 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.782 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.567 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.936 HG21 ' HA ' ' A' ' 3' ' ' HIS . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.58 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.6 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 13.5 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.648 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.6 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.885 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.846 0.355 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.403 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.684 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.825 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.684 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.48 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.48 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.563 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.664 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.52 ' OE2' HG22 ' A' ' 41' ' ' VAL . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.603 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.44 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD2' HG11 ' A' ' 12' ' ' VAL . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.714 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.52 HG22 ' OE2' ' A' ' 26' ' ' GLU . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.714 HD11 HG13 ' A' ' 40' ' ' VAL . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.097 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.463 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB3' ' HD2' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.779 0.323 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.585 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.463 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.545 ' CD1' HD12 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.465 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.313 0.577 . . . . 0.0 111.443 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.808 ' HG3' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.808 HG22 ' HG3' ' A' ' 71' ' ' LYS . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 71' ' ' LYS . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.428 ' HG2' HG23 ' A' ' 63' ' ' ILE . 23.7 Cg_endo . . . . . 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.745 0.307 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.508 ' O ' HD12 ' A' ' 8' ' ' ILE . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HD2' HG13 ' A' ' 96' ' ' VAL . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.572 ' HB3' HG12 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.621 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.46 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.681 HG22 HD22 ' A' ' 104' ' ' LEU . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 3' ' ' HIS . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.681 HD22 HG22 ' A' ' 100' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.464 ' HA ' HD12 ' A' ' 108' ' ' ILE . 16.4 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.8 mm100 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 1.097 HD11 HD13 ' A' ' 48' ' ' LEU . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.924 ' HA ' HG21 ' A' ' 103' ' ' THR . 40.9 p-80 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.788 0.327 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.75 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.75 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.497 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.656 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HG2' HG22 ' A' ' 41' ' ' VAL . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.633 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.449 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HD3' HG11 ' A' ' 12' ' ' VAL . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.625 HG13 HD11 ' A' ' 45' ' ' ILE . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.625 HD11 HG13 ' A' ' 40' ' ' VAL . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.643 ' CE ' HG21 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.552 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.72 0.295 . . . . 0.0 110.797 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.643 HG21 ' CE ' ' A' ' 47' ' ' LYS . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.833 0.349 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.415 HG13 ' HD2' ' A' ' 82' ' ' PRO . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.415 ' HD2' HG13 ' A' ' 81' ' ' VAL . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.465 ' CE1' HG22 ' A' ' 40' ' ' VAL . 8.4 m80 . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.71 0.29 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 16' ' ' ILE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.545 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.759 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.759 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.447 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.41 ' N ' ' HG3' ' A' ' 97' ' ' MET . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.497 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.633 HD11 ' CD1' ' A' ' 27' ' ' LEU . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.585 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.826 HD12 ' O ' ' A' ' 103' ' ' THR . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.585 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.826 ' HA ' HG21 ' A' ' 103' ' ' THR . 14.5 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.864 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.469 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.55 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.561 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.561 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.451 ' HG2' HG22 ' A' ' 41' ' ' VAL . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.658 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.467 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 108' ' ' ILE . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.891 HD11 HG13 ' A' ' 40' ' ' VAL . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.43 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.747 0.308 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD11 ' HG3' ' A' ' 97' ' ' MET . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.796 0.331 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.433 HG13 ' HD2' ' A' ' 82' ' ' PRO . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD2' HG13 ' A' ' 81' ' ' VAL . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.677 0.275 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.482 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HD2' HG13 ' A' ' 96' ' ' VAL . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.462 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.735 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.567 ' HG3' HD11 ' A' ' 60' ' ' LEU . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.566 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.551 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.658 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.59 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 14.4 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.804 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.857 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.864 0.364 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.647 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.755 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.66 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.821 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.66 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.755 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 26' ' ' GLU . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' H ' ' A' ' 25' ' ' ALA . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.488 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.581 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.407 ' CG ' ' HB3' ' A' ' 19' ' ' ASN . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.622 ' HB2' HD21 ' A' ' 42' ' ' LEU . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.436 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.734 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.52 HG12 ' H ' ' A' ' 43' ' ' SER . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 1.071 HG21 HD23 ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' A' ' 61' ' ' ARG . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.417 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.728 0.299 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.071 HD23 HG21 ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 84' ' ' PRO . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.745 0.307 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.854 ' HE3' HG22 ' A' ' 81' ' ' VAL . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.854 HG22 ' HE3' ' A' ' 71' ' ' LYS . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HG2' HG23 ' A' ' 63' ' ' ILE . 85.3 Cg_endo . . . . . 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 . . . . . 0 N--CA 1.458 -0.043 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.56 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.615 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.3 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.615 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.526 ' N ' HG13 ' A' ' 96' ' ' VAL . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.647 HD11 ' N ' ' A' ' 5' ' ' GLY . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' HB2' ' A' ' 50' ' ' ALA . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.857 HG21 ' HA ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 7.9 mm100 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.578 HG23 ' HB3' ' A' ' 25' ' ' ALA . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.822 HD11 HD13 ' A' ' 48' ' ' LEU . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.599 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.454 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.699 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.836 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.836 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.545 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.545 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.699 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.81 HG21 HD11 ' A' ' 107' ' ' ILE . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.677 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.736 ' CD ' HG11 ' A' ' 12' ' ' VAL . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.696 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 42' ' ' LEU . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 40' ' ' VAL . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.761 ' HB2' HD11 ' A' ' 108' ' ' ILE . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 9.0 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HE1' ' SD ' ' A' ' 97' ' ' MET . 3.3 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.73 0.3 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.906 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.413 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.832 0.348 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.51 ' O ' HG22 ' A' ' 80' ' ' VAL . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' HG13 ' A' ' 80' ' ' VAL . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 78' ' ' ASN . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.412 HG13 ' HD2' ' A' ' 82' ' ' PRO . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD2' HG13 ' A' ' 81' ' ' VAL . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CD2' HG22 ' A' ' 40' ' ' VAL . 25.4 m-70 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 8' ' ' ILE . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.618 ' HB3' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.403 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.618 HG13 ' HB3' ' A' ' 93' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG23 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.738 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.599 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.733 HD23 ' CD1' ' A' ' 48' ' ' LEU . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.81 HD11 HG21 ' A' ' 18' ' ' ILE . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 48' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.921 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.4 p-80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.91 0.386 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.434 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.747 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.698 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.853 ' O ' HG12 ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.871 HG11 ' CD ' ' A' ' 36' ' ' LYS . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.698 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.443 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.747 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.625 HG13 HD12 ' A' ' 27' ' ' LEU . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.549 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.457 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.472 ' HG2' HG22 ' A' ' 41' ' ' VAL . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.625 HD12 HG13 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.871 ' CD ' HG11 ' A' ' 12' ' ' VAL . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.878 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 44' ' ' THR . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.485 HG23 ' HB ' ' A' ' 41' ' ' VAL . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.878 HD11 HG13 ' A' ' 40' ' ' VAL . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.43 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.731 HD12 HD13 ' A' ' 62' ' ' LEU . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.573 ' O ' HD13 ' A' ' 60' ' ' LEU . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.332 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.425 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.731 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.495 HG13 ' HG3' ' A' ' 47' ' ' LYS . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.738 0.304 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 81' ' ' VAL . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.813 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 71' ' ' LYS . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.813 ' HD3' HG23 ' A' ' 80' ' ' VAL . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.411 ' CE1' HG22 ' A' ' 40' ' ' VAL . 17.4 m80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.765 0.317 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.537 ' O ' HD12 ' A' ' 8' ' ' ILE . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.539 ' HD2' HG22 ' A' ' 96' ' ' VAL . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.662 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.662 HG12 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.503 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.603 HG23 HD13 ' A' ' 104' ' ' LEU . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.921 HG21 ' HA ' ' A' ' 3' ' ' HIS . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.603 HD13 HG23 ' A' ' 100' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.534 HD11 HG21 ' A' ' 18' ' ' ILE . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.613 HD11 ' HB2' ' A' ' 48' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.445 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.445 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.817 ' HA ' HG21 ' A' ' 103' ' ' THR . 37.1 p-80 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.829 0.347 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.712 ' HB3' HG13 ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.714 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.88 ' O ' HG12 ' A' ' 12' ' ' VAL . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.88 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.712 HG13 ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.562 HG21 HD11 ' A' ' 107' ' ' ILE . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.588 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.588 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.641 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.564 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.834 ' HD2' HG11 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.685 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 108' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.685 HD11 HG13 ' A' ' 40' ' ' VAL . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.508 HD21 ' CD2' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.782 0.325 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 97' ' ' MET . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.776 0.322 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' CG ' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.945 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.421 HG22 ' CG ' ' A' ' 71' ' ' LYS . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo . . . . . 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.68 0.276 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.58 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.77 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.77 HG12 ' HB3' ' A' ' 93' ' ' ASN . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.512 ' HG3' HD11 ' A' ' 60' ' ' LEU . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.58 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.817 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.564 HD11 ' CD1' ' A' ' 27' ' ' LEU . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.592 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.6 mm100 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.843 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.4 m80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.892 0.377 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.777 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 13' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.783 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.794 HG21 ' CD ' ' A' ' 36' ' ' LYS . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.734 ' HA ' HD12 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.777 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.778 HG11 ' OE1' ' A' ' 26' ' ' GLU . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.459 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.778 ' OE1' HG11 ' A' ' 22' ' ' VAL . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.613 HD12 HG13 ' A' ' 18' ' ' ILE . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.611 HG21 ' NH1' ' A' ' 30' ' ' ARG . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.414 ' CH2' HG13 ' A' ' 12' ' ' VAL . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.611 ' NH1' HG21 ' A' ' 28' ' ' THR . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.794 ' CD ' HG21 ' A' ' 12' ' ' VAL . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.476 HG22 ' HG2' ' A' ' 26' ' ' GLU . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.445 ' HB3' HG12 ' A' ' 41' ' ' VAL . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.77 HD23 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.411 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.452 ' HA ' HD12 ' A' ' 60' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.836 0.351 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.424 ' HB2' ' HE3' ' A' ' 59' ' ' MET . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.495 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HG3' ' HE3' ' A' ' 88' ' ' MET . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.559 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.475 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.434 ' O ' HG13 ' A' ' 80' ' ' VAL . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' ASN . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.414 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 72.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.541 ' HE3' ' HG3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.436 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.627 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.627 HG12 ' CB ' ' A' ' 93' ' ' ASN . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.461 ' N ' HG13 ' A' ' 96' ' ' VAL . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.597 HD12 ' CG2' ' A' ' 16' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD22 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.843 HG21 ' HA ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.77 ' HB3' HD23 ' A' ' 48' ' ' LEU . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.8 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.449 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.891 ' HA ' HG21 ' A' ' 103' ' ' THR . 13.4 m80 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.865 0.364 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.746 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.683 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.556 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.556 HD13 ' O ' ' A' ' 14' ' ' GLY . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.746 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.509 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.555 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.555 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.753 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.408 ' HD1' HG13 ' A' ' 16' ' ' ILE . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.875 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 107' ' ' ILE . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.875 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.024 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.782 0.325 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.569 ' C ' HD12 ' A' ' 60' ' ' LEU . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.736 HD11 ' HG3' ' A' ' 97' ' ' MET . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.88 0.372 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.797 0.332 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.561 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.553 ' CD1' HD13 ' A' ' 60' ' ' LEU . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.805 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' ASN . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.736 ' HG3' HD11 ' A' ' 60' ' ' LEU . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.526 HG23 HD13 ' A' ' 104' ' ' LEU . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' ' 48' ' ' LEU . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.802 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 1.024 HD11 HD13 ' A' ' 48' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.878 ' HA ' HG21 ' A' ' 103' ' ' THR . 6.0 m80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.894 0.378 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.411 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.79 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.79 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.534 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.635 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.464 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.755 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.72 HD12 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' N ' HD22 ' A' ' 48' ' ' LEU . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.724 0.297 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.68 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.471 ' CD2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.82 0.343 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.68 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.886 ' HB3' HG12 ' A' ' 96' ' ' VAL . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.886 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.511 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.602 ' CG2' HD13 ' A' ' 104' ' ' LEU . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.878 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.602 HD13 ' CG2' ' A' ' 100' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 103' ' ' THR . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 48' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 25' ' ' ALA . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.89 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.892 0.377 . . . . 0.0 111.163 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.756 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.438 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.813 ' O ' HG12 ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.813 HG12 ' O ' ' A' ' 9' ' ' PHE . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.564 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.756 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.783 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 26' ' ' GLU . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.429 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.511 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.711 ' HE2' HG11 ' A' ' 12' ' ' VAL . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.811 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.517 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.811 HD11 HG13 ' A' ' 40' ' ' VAL . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.566 ' HB3' HG22 ' A' ' 63' ' ' ILE . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 62' ' ' LEU . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.903 HD13 ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.448 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 46' ' ' ASP . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.502 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.4 ' CD ' ' HG3' ' A' ' 82' ' ' PRO . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' HG13 ' A' ' 80' ' ' VAL . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 78' ' ' ASN . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD3' HG23 ' A' ' 80' ' ' VAL . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.408 ' CB ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HG2' HG23 ' A' ' 63' ' ' ILE . 35.3 Cg_endo . . . . . 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.568 ' CE1' HG22 ' A' ' 40' ' ' VAL . 13.7 m80 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.903 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.539 ' HB3' HG12 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.728 HG13 ' HD2' ' A' ' 91' ' ' PHE . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.465 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.607 HD12 ' CG2' ' A' ' 16' ' ' ILE . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' HD21 ' A' ' 48' ' ' LEU . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.503 ' O ' ' NE2' ' A' ' 106' ' ' GLN . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.89 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.712 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.406 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.503 ' NE2' ' O ' ' A' ' 102' ' ' MET . 1.8 mp0 -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.783 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.908 ' HA ' HG21 ' A' ' 103' ' ' THR . 9.2 m80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.916 0.389 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.517 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.768 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.575 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.865 ' O ' HG12 ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.497 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.497 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.768 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.561 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.533 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HG12 ' A' ' 16' ' ' ILE . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.442 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.401 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HE3' HG21 ' A' ' 63' ' ' ILE . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.601 HE22 HD11 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.911 0.386 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.848 HD11 ' HG3' ' A' ' 97' ' ' MET . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.465 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.601 HD11 HE22 ' A' ' 49' ' ' GLN . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.7 0.286 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 80' ' ' VAL . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 78' ' ' ASN . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.716 0.293 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.757 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.804 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.6 OUTLIER -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.804 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.848 ' HG3' HD11 ' A' ' 60' ' ' LEU . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.605 HG23 HD13 ' A' ' 104' ' ' LEU . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.908 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.605 HD13 HG23 ' A' ' 100' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.561 ' CD1' HG21 ' A' ' 18' ' ' ILE . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.954 ' HA ' HG21 ' A' ' 103' ' ' THR . 2.5 p-80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.925 0.393 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.758 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.787 ' O ' HG12 ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.787 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.758 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.585 HG21 HD11 ' A' ' 107' ' ' ILE . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.588 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' HG21 ' A' ' 22' ' ' VAL . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.719 ' CE ' HG11 ' A' ' 12' ' ' VAL . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.73 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 108' ' ' ILE . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.414 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.73 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' HG3' HG13 ' A' ' 63' ' ' ILE . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.6 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.783 0.325 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.509 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.785 0.326 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.405 HG13 ' HD2' ' A' ' 82' ' ' PRO . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.405 ' HD2' HG13 ' A' ' 81' ' ' VAL . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 57.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.737 0.303 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.592 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB2' HG12 ' A' ' 96' ' ' VAL . 5.1 m120 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.704 HG12 ' HB2' ' A' ' 93' ' ' ASN . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.954 HG21 ' HA ' ' A' ' 3' ' ' HIS . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.717 HD11 ' CD1' ' A' ' 27' ' ' LEU . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.575 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 16.8 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm100 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 103' ' ' THR . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD11 HD12 ' A' ' 42' ' ' LEU . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.803 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.9 m80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.783 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.892 ' O ' HG12 ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.781 ' HA ' HD12 ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.783 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.562 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.562 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.719 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.852 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG22 ' CD ' ' A' ' 26' ' ' GLU . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.852 HD11 HG13 ' A' ' 40' ' ' VAL . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.87 HD21 ' HA ' ' A' ' 101' ' ' LYS . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.492 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.76 0.314 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.853 0.359 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.477 ' O ' HG13 ' A' ' 80' ' ' VAL . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.668 ' CE1' HG22 ' A' ' 40' ' ' VAL . 31.8 m80 . . . . . 0 C--O 1.23 0.046 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.421 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.595 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.595 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.506 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.572 HG23 HD13 ' A' ' 104' ' ' LEU . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.87 ' HA ' HD21 ' A' ' 48' ' ' LEU . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.803 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.719 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' A' ' 18' ' ' ILE . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 107' ' ' ILE . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.534 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.2 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.744 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.685 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.884 HG11 ' HD3' ' A' ' 36' ' ' LYS . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.685 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.744 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.58 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.719 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.499 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.884 ' HD3' HG11 ' A' ' 12' ' ' VAL . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.867 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.867 HD11 HG13 ' A' ' 40' ' ' VAL . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.076 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' SD ' ' A' ' 97' ' ' MET . 1.4 mtp . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.836 0.35 . . . . 0.0 110.832 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 97' ' ' MET . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HG2' ' HE3' ' A' ' 88' ' ' MET . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.539 HD11 HG21 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 80' ' ' VAL . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 78' ' ' ASN . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.752 0.31 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.443 ' HE3' ' HG2' ' A' ' 61' ' ' ARG . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 8' ' ' ILE . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.56 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.56 HG12 ' CB ' ' A' ' 93' ' ' ASN . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.496 HG22 HD22 ' A' ' 104' ' ' LEU . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 107' ' ' ILE . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.601 ' CD2' HD21 ' A' ' 48' ' ' LEU . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 108' ' ' ILE . 15.7 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.719 HG23 ' HB3' ' A' ' 25' ' ' ALA . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 1.076 HD11 HD13 ' A' ' 48' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.758 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.753 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.59 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.867 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.867 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.753 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.788 HG21 HD11 ' A' ' 107' ' ' ILE . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.598 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.598 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.739 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.847 ' CD ' HG11 ' A' ' 12' ' ' VAL . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.952 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 104' ' ' LEU . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.43 ' HA ' ' CE1' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.952 HD11 HG13 ' A' ' 40' ' ' VAL . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' H ' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.506 ' NE2' ' CB ' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.797 0.332 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.456 ' C ' HD12 ' A' ' 60' ' ' LEU . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.999 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.506 ' CB ' ' NE2' ' A' ' 49' ' ' GLN . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.586 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.473 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.1 t0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.78 0.324 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.489 ' O ' HG13 ' A' ' 80' ' ' VAL . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.489 HG13 ' O ' ' A' ' 78' ' ' ASN . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 58.6 Cg_endo . . . . . 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.799 0.333 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 8' ' ' ILE . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.999 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 96' ' ' VAL . 0.6 OUTLIER -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.745 HG13 ' HD2' ' A' ' 91' ' ' PHE . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.533 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.794 ' CD1' HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.444 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.788 HD11 HG21 ' A' ' 18' ' ' ILE . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.794 HD11 ' CD1' ' A' ' 104' ' ' LEU . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.914 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.854 0.359 . . . . 0.0 111.1 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.73 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.835 ' O ' HG12 ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.492 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.73 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG23 ' A' ' 16' ' ' ILE . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.723 ' CE ' HG11 ' A' ' 12' ' ' VAL . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.731 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.731 HD11 HG13 ' A' ' 40' ' ' VAL . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HG3' ' CG1' ' A' ' 63' ' ' ILE . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.706 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.298 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' A' ' 101' ' ' LYS . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.765 0.317 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 80' ' ' VAL . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.4 ' CG1' ' HD2' ' A' ' 82' ' ' PRO . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' A' ' 81' ' ' VAL . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.765 0.317 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.498 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HD2' HG22 ' A' ' 96' ' ' VAL . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.639 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.639 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.517 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.619 HG23 HD13 ' A' ' 104' ' ' LEU . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.501 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.514 ' O ' ' NE2' ' A' ' 106' ' ' GLN . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.914 HG21 ' HA ' ' A' ' 3' ' ' HIS . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.706 ' CB ' HD21 ' A' ' 48' ' ' LEU . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 1.3 tt0 -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 102' ' ' MET . 1.8 mp0 -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.441 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.705 HD11 ' CD1' ' A' ' 48' ' ' LEU . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.5 ' HA ' HG21 ' A' ' 103' ' ' THR . 15.3 m80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.825 0.345 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.775 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.668 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.668 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.775 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.785 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.768 HG21 ' HG3' ' A' ' 26' ' ' GLU . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.469 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.768 ' HG3' HG21 ' A' ' 22' ' ' VAL . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.818 ' HD2' HG11 ' A' ' 12' ' ' VAL . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.512 HG22 ' HG2' ' A' ' 26' ' ' GLU . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.44 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.83 HD12 HD13 ' A' ' 62' ' ' LEU . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.807 0.336 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.521 ' C ' HD12 ' A' ' 60' ' ' LEU . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' C ' ' A' ' 59' ' ' MET . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.83 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.761 0.315 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 9.5 m80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.806 0.336 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 8' ' ' ILE . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CD2' HG22 ' A' ' 96' ' ' VAL . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.689 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.689 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.497 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.403 ' O ' ' HE2' ' A' ' 102' ' ' MET . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.812 HG23 HD13 ' A' ' 104' ' ' LEU . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.403 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.564 ' CG2' HD13 ' A' ' 18' ' ' ILE . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.812 HD13 HG23 ' A' ' 100' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.785 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 48' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.812 0.255 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 p -99.48 -68.84 0.79 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.892 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -83.36 56.89 3.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.833 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.833 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.647 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.716 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.599 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.872 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.805 ' HD2' HG11 ' A' ' 12' ' ' VAL . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.538 HG12 ' H ' ' A' ' 43' ' ' SER . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HG13 ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.538 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 1.031 HD12 ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.837 ' HE2' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.661 ' CD1' HD23 ' A' ' 104' ' ' LEU . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . -161.54 133.97 5.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.515 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 32.9 p -86.24 99.42 1.03 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.135 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.515 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.22 163.73 0.22 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.417 2.745 . . . . 0.0 112.288 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.42 -18.72 7.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.426 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -71.24 -20.98 62.17 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.786 0.327 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -93.29 121.15 34.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.14 -24.13 62.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.109 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -98.38 115.26 28.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.856 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt -91.15 106.12 18.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.906 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 95' ' ' PHE . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.595 HD13 ' CD1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.031 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.837 HG21 ' HE2' ' A' ' 47' ' ' LYS . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.03 136.67 52.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.679 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.6 p -106.58 -123.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.149 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.679 ' H ' HG13 ' A' ' 66' ' ' VAL . 14.3 t0 -171.41 111.01 0.32 Allowed 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.516 ' O ' HG13 ' A' ' 80' ' ' VAL . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.643 ' O ' HG21 ' A' ' 66' ' ' VAL . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -75.57 130.67 12.9 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.66 115.02 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.526 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.4 ptt85 -120.72 153.52 36.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.257 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.401 ' NE2' HG22 ' A' ' 40' ' ' VAL . 4.8 m-70 -107.61 111.14 23.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.395 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.448 ' HE3' ' CZ ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.573 ' O ' HD12 ' A' ' 8' ' ' ILE . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.595 ' CD1' HD13 ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.571 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.571 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.613 HG23 HD13 ' A' ' 104' ' ' LEU . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.892 HG21 ' HA ' ' A' ' 3' ' ' HIS . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.872 HD11 ' CD1' ' A' ' 27' ' ' LEU . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.584 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 42' ' ' LEU . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.584 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.47 -49.61 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -56.15 -40.59 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.062 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.87 -48.06 22.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.885 0.374 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.24 15.07 11.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.387 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.79 -30.43 19.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -62.2 -31.08 71.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -113.38 23.94 12.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.118 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.489 ' HA ' HG22 ' A' ' 51' ' ' THR . 0.3 OUTLIER -169.1 135.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.833 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.43 161.45 13.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -96.07 162.03 13.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.495 HG12 ' H ' ' B' ' 99' ' ' THR . 2.4 t -135.17 167.19 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.568 ' O ' HG23 ' B' ' 99' ' ' THR . 11.1 t -47.27 107.14 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.25 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -91.92 175.85 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -65.63 -156.62 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.499 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -79.48 154.14 29.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.775 0.321 . . . . 0.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -157.14 -52.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.121 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.488 1.182 0 CA-C-O 120.843 0.268 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.2 m -100.92 30.86 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.936 ' HA ' HG21 ' A' ' 103' ' ' THR . 5.7 p-80 -176.35 48.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.431 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.664 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.861 ' O ' HG12 ' A' ' 12' ' ' VAL . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.443 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.861 HG12 ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.664 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.634 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG21 ' HG3' ' A' ' 26' ' ' GLU . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.445 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.613 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HG3' HG21 ' A' ' 22' ' ' VAL . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.58 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.772 ' CD ' HG11 ' A' ' 12' ' ' VAL . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.815 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.815 HD11 HG13 ' A' ' 40' ' ' VAL . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.434 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.408 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -154.41 132.08 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.715 HG21 ' O ' ' A' ' 57' ' ' LYS . 3.0 p -56.79 103.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.302 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' A' ' 50' ' ' ALA . 9.6 Cg_endo -48.45 163.75 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.375 2.716 . . . . 0.0 112.316 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.42 -21.74 3.98 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.358 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 p -76.94 -21.47 54.75 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.774 0.321 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m -94.06 99.89 12.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.51 -23.09 57.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.221 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.715 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.67 117.05 23.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.109 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.428 ' HB3' ' HB2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -73.71 107.69 6.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.102 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 60' ' ' LEU . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.733 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 138.43 45.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.819 HG21 ' O ' ' A' ' 82' ' ' PRO . 14.5 p -108.95 -124.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.042 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.048 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.668 ' H ' HG13 ' A' ' 66' ' ' VAL . 34.4 t0 -178.14 86.14 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.781 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.447 ' O ' HG13 ' A' ' 80' ' ' VAL . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' ASN . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.819 ' O ' HG21 ' A' ' 66' ' ' VAL . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -76.07 150.88 34.22 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -61.05 114.52 3.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.515 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -105.47 114.19 28.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.268 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -93.26 111.27 22.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.386 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.535 ' HE1' ' CZ ' ' B' ' 95' ' ' PHE . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.534 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.733 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.782 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.567 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.936 HG21 ' HA ' ' A' ' 3' ' ' HIS . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.58 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.6 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 13.5 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.648 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.6 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -67.61 0.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.82 -31.39 68.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.96 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.58 -43.22 69.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.11 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.933 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -90.03 -30.85 17.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.95 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.11 4.13 39.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -58.88 -23.71 61.33 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.633 0.254 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' B' ' 95' ' ' PHE . 0.7 OUTLIER -108.42 -51.58 2.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.987 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.535 ' CZ ' ' HE1' ' A' ' 88' ' ' MET . 6.0 m-85 -116.84 175.01 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.831 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 152.89 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.967 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.26 162.0 14.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.911 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.531 ' O ' HG13 ' B' ' 98' ' ' VAL . 11.3 p -143.79 116.9 3.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -147.06 -175.36 4.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.848 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.13 -57.54 2.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 150.87 130.32 1.7 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.532 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -83.71 104.02 13.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.343 . . . . 0.0 110.96 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -105.79 -65.46 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.017 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.488 1.195 0 CA-C-O 120.774 0.239 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -106.73 -44.33 4.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.885 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -96.27 39.56 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.403 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.684 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.825 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.684 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.48 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.563 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.664 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.52 ' OE2' HG22 ' A' ' 41' ' ' VAL . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.603 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.44 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD2' HG11 ' A' ' 12' ' ' VAL . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.714 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.52 HG22 ' OE2' ' A' ' 26' ' ' GLU . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.714 HD11 HG13 ' A' ' 40' ' ' VAL . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.097 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.463 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB3' ' HD2' ' A' ' 101' ' ' LYS . . . -139.63 141.6 37.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.494 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 22.3 p -85.76 99.51 0.99 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.494 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.34 163.76 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.417 2.745 . . . . 0.0 112.382 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.77 -19.19 3.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.524 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.21 -20.68 62.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.311 . . . . 0.0 111.111 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 m -93.13 118.3 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.46 -23.93 63.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.076 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -100.01 115.4 29.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.793 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp -87.08 106.0 17.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.883 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' THR . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.585 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.463 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.545 ' CD1' HD12 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.465 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.19 134.42 36.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.937 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -91.56 -3.89 10.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 122.218 1.008 . . . . 0.0 110.818 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 66' ' ' VAL . 0.4 OUTLIER 81.07 -176.86 0.06 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.443 179.677 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.808 ' HG3' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.808 HG22 ' HG3' ' A' ' 71' ' ' LYS . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.873 ' O ' HG21 ' A' ' 66' ' ' VAL . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.937 ' HA ' HG23 ' A' ' 66' ' ' VAL . 23.7 Cg_endo -61.12 -166.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.87 172.5 10.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.353 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.88 109.41 2.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.868 0.366 . . . . 0.0 111.444 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 -105.58 111.1 23.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.404 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.508 ' O ' HD12 ' A' ' 8' ' ' ILE . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HD2' HG13 ' A' ' 96' ' ' VAL . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.572 ' HB3' HG12 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.621 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.46 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.681 HG22 HD22 ' A' ' 104' ' ' LEU . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 3' ' ' HIS . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.681 HD22 HG22 ' A' ' 100' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.464 ' HA ' HD12 ' A' ' 108' ' ' ILE . 16.4 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.8 mm100 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 1.097 HD11 HD13 ' A' ' 48' ' ' LEU . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -111.61 -65.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -60.73 -32.47 71.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.74 -37.6 82.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.077 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.887 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.791 0.329 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -89.85 -31.41 17.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.858 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.3 t -68.76 -31.17 70.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.897 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -75.1 -49.18 20.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -75.69 -31.02 59.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.948 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -132.92 135.01 45.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -100.08 136.45 39.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.931 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -96.03 138.95 32.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.494 HG12 ' N ' ' B' ' 99' ' ' THR . 21.3 t -92.1 161.27 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.832 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.494 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.7 t -46.99 126.31 8.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.268 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.55 -47.13 7.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.931 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 173.89 -131.89 2.15 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -155.15 31.86 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.839 0.352 . . . . 0.0 110.898 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -141.63 87.56 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.918 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.119 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.488 1.167 0 CA-C-O 121.093 0.372 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.93 -51.82 55.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.927 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.924 ' HA ' HG21 ' A' ' 103' ' ' THR . 40.9 p-80 -109.14 42.67 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.921 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.75 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.75 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.497 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.656 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HG2' HG22 ' A' ' 41' ' ' VAL . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.633 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.449 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HD3' HG11 ' A' ' 12' ' ' VAL . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.625 HG13 HD11 ' A' ' 45' ' ' ILE . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.625 HD11 HG13 ' A' ' 40' ' ' VAL . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.643 ' CE ' HG21 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.552 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.447 ' HA ' HG23 ' B' ' 98' ' ' VAL . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.63 131.32 4.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.508 HG23 ' O ' ' A' ' 59' ' ' MET . 57.6 p -62.51 148.49 90.35 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.378 0.608 . . . . 0.0 110.962 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -85.04 164.33 11.53 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.83 3.02 . . . . 0.0 112.328 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.19 -6.2 8.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.168 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.6 m -90.37 -21.43 21.99 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.794 0.331 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.5 t -96.39 117.6 31.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.883 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -21.25 58.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.104 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.67 118.5 23.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.897 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.73 106.06 18.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.797 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.508 ' O ' HG23 ' A' ' 51' ' ' THR . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' B' ' 95' ' ' PHE . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.643 HG21 ' CE ' ' A' ' 47' ' ' LYS . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.86 138.13 58.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.672 HG13 ' H ' ' A' ' 67' ' ' ASP . 11.6 p -104.09 -122.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.249 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.672 ' H ' HG13 ' A' ' 66' ' ' VAL . 6.6 m-20 -161.18 122.69 2.93 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.848 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.415 HG13 ' HD2' ' A' ' 82' ' ' PRO . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.663 ' O ' HG21 ' A' ' 66' ' ' VAL . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.31 139.49 23.55 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 114.98 2.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.508 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -117.61 147.49 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 0.0 111.532 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.465 ' CE1' HG22 ' A' ' 40' ' ' VAL . 8.4 m80 -117.08 116.04 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.288 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 16' ' ' ILE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.545 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.759 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.759 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.447 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.41 ' N ' ' HG3' ' A' ' 97' ' ' MET . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.497 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.633 HD11 ' CD1' ' A' ' 27' ' ' LEU . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.585 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.826 HD12 ' O ' ' A' ' 103' ' ' THR . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.585 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.51 -57.01 14.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.65 -31.38 69.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.9 -40.37 47.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.2 t0 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.926 -179.977 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.874 0.369 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -74.45 -31.46 62.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 78.2 p -66.02 -28.8 69.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.013 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -58.45 -39.88 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.989 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -100.98 -34.48 9.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.865 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.439 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -99.34 139.01 35.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.843 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -94.05 163.18 13.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.994 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -96.06 162.0 13.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 48' ' ' LEU . 4.0 t -135.2 164.45 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.836 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.511 ' O ' HG23 ' B' ' 99' ' ' THR . 11.7 t -46.95 112.16 0.48 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.31 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -134.55 -48.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.58 -29.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.515 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.8 t30 61.02 157.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.797 0.332 . . . . 0.0 110.913 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -168.56 -46.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.881 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.133 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.162 0 CA-C-O 120.841 0.267 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 p -75.77 -31.59 59.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.928 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.826 ' HA ' HG21 ' A' ' 103' ' ' THR . 14.5 m80 -98.24 38.49 1.32 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.864 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.55 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.561 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.561 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.451 ' HG2' HG22 ' A' ' 41' ' ' VAL . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.658 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.467 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 108' ' ' ILE . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.891 HD11 HG13 ' A' ' 40' ' ' VAL . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.43 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.33 132.55 29.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.518 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -51.28 101.79 0.28 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.43 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.518 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -47.46 163.91 0.16 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.439 2.759 . . . . 0.0 112.171 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -49.43 -22.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.482 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -73.48 -21.53 60.4 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.761 0.315 . . . . 0.0 111.136 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.408 ' HB2' ' HB ' ' A' ' 51' ' ' THR . 20.0 m -97.34 115.17 27.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.843 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -77.43 -16.94 58.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.499 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' H ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 123.27 29.71 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 120.754 0.311 . . . . 0.0 111.168 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.37 106.08 5.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.669 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG3' HG23 ' A' ' 51' ' ' THR . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD11 ' HG3' ' A' ' 97' ' ' MET . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -56.42 143.95 32.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.8 p -105.75 -123.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.094 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.675 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.5 p30 -172.25 120.01 0.42 Allowed 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.93 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.451 HG12 HG21 ' A' ' 66' ' ' VAL . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD2' HG13 ' A' ' 81' ' ' VAL . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.76 142.27 47.47 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -61.99 116.29 4.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.2 ptt-85 -125.91 160.7 29.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.214 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -114.39 151.22 33.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.659 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.482 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HD2' HG13 ' A' ' 96' ' ' VAL . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.462 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.735 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.567 ' HG3' HD11 ' A' ' 60' ' ' LEU . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.566 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.551 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.658 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.59 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 14.4 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.804 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm -60.24 -58.68 7.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.39 -31.29 69.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.68 -34.5 58.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.833 -179.938 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.825 0.345 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -74.16 -48.43 29.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.1 -31.24 23.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -59.9 -31.38 69.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.994 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.05 -31.57 72.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.04 135.04 33.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.816 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -114.31 152.64 31.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -86.08 161.96 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.99 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.615 HG13 ' OE1' ' B' ' 103' ' ' GLU . 11.6 t -136.01 107.05 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.02 134.02 20.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.859 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 64.64 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -168.73 -150.55 6.72 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.456 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 60.4 86.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 110.92 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLU . . . . . 0.615 ' OE1' HG13 ' B' ' 98' ' ' VAL . 2.0 tp10 -125.79 84.91 2.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.893 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.118 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.167 0.403 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -56.76 4.25 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.941 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.857 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 -97.75 38.81 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.647 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.755 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.66 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.821 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.66 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.755 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 26' ' ' GLU . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' H ' ' A' ' 25' ' ' ALA . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.488 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.581 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.407 ' CG ' ' HB3' ' A' ' 19' ' ' ASN . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.622 ' HB2' HD21 ' A' ' 42' ' ' LEU . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.436 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.734 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.52 HG12 ' H ' ' A' ' 43' ' ' SER . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 1.071 HG21 HD23 ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HA ' HG23 ' B' ' 98' ' ' VAL . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.417 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . -161.49 132.8 5.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.572 HG23 ' O ' ' A' ' 59' ' ' MET . 20.4 p -85.88 99.59 1.04 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.58 163.74 0.17 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.425 2.75 . . . . 0.0 112.292 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.3 -17.2 7.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.512 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 m -71.24 -21.39 62.12 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.781 0.324 . . . . 0.0 111.222 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -88.4 124.16 33.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.899 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -60.67 -29.3 69.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.979 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.07 121.68 43.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.838 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp -90.42 105.91 18.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.092 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.572 ' O ' HG23 ' A' ' 51' ' ' THR . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.071 HD23 HG21 ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.507 HD12 HH11 ' A' ' 86' ' ' ARG . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.72 137.97 37.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.841 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.8 p -112.78 -126.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.074 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.687 ' N ' HG13 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -179.87 106.57 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.707 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.854 ' HE3' HG22 ' A' ' 81' ' ' VAL . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.854 HG22 ' HE3' ' A' ' 71' ' ' LYS . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.841 ' O ' HG21 ' A' ' 66' ' ' VAL . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HG2' HG23 ' A' ' 63' ' ' ILE . 85.3 Cg_endo -79.29 178.92 6.89 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -78.4 165.61 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.339 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.507 HH11 HD12 ' A' ' 63' ' ' ILE . 33.4 mtt-85 -151.79 109.32 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 0.0 111.501 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.6 111.09 22.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.081 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.56 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.615 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.3 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.615 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.526 ' N ' HG13 ' A' ' 96' ' ' VAL . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.647 HD11 ' N ' ' A' ' 5' ' ' GLY . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' HB2' ' A' ' 50' ' ' ALA . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.857 HG21 ' HA ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 1.4 tt0 -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 7.9 mm100 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.578 HG23 ' HB3' ' A' ' 25' ' ' ALA . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.822 HD11 HD13 ' A' ' 48' ' ' LEU . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.7 -66.83 0.38 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -58.69 -31.44 68.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.64 -62.74 1.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.169 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.886 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.855 0.36 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.49 -39.66 37.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 58.7 m -60.17 -34.46 73.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.88 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -31.16 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.37 -62.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.465 ' CE1' ' HE3' ' A' ' 59' ' ' MET . 1.6 m-85 -83.15 158.21 22.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.734 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.97 148.69 21.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.08 162.08 13.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.502 HG12 ' N ' ' B' ' 99' ' ' THR . 9.7 t -126.52 163.98 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.847 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.502 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.4 t -46.85 138.9 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.898 0.38 . . . . 0.0 111.252 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.94 -172.38 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.865 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -95.07 -62.28 1.01 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.482 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -160.3 -176.83 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLU . . . . . 0.636 ' HG3' HG12 ' B' ' 104' ' ' VAL . 15.4 pt-20 -131.95 -46.57 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.636 HG12 ' HG3' ' B' ' 103' ' ' GLU . 10.0 p . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.12 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 N--CA 1.489 1.21 0 CA-C-O 120.881 0.284 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m -84.45 2.92 38.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.409 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.599 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 60.78 38.45 18.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.454 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.699 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.836 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.836 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.545 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.545 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.699 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.81 HG21 HD11 ' A' ' 107' ' ' ILE . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.677 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.736 ' CD ' HG11 ' A' ' 12' ' ' VAL . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.696 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 42' ' ' LEU . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 40' ' ' VAL . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.761 ' HB2' HD11 ' A' ' 108' ' ' ILE . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 9.0 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.53 132.56 5.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 59' ' ' MET . 35.1 p -84.78 99.6 0.88 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.12 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.474 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.41 163.75 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 123.486 2.791 . . . . 0.0 112.328 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.76 -17.73 6.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.519 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -71.17 -21.15 62.21 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -90.97 123.6 34.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.871 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.21 -24.58 63.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -99.69 135.34 41.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.84 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HE1' ' SD ' ' A' ' 97' ' ' MET . 3.3 mtp -105.74 105.94 16.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.899 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.86 ' O ' HG23 ' A' ' 51' ' ' THR . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.906 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.413 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.673 HD13 ' HB3' ' A' ' 86' ' ' ARG . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.09 143.51 48.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.718 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.6 p -111.28 -126.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.027 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG13 ' A' ' 66' ' ' VAL . 0.8 OUTLIER -142.47 -175.88 4.63 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.918 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.51 ' O ' HG22 ' A' ' 80' ' ' VAL . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' HG13 ' A' ' 80' ' ' VAL . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 78' ' ' ASN . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.618 ' CG1' HG22 ' A' ' 66' ' ' VAL . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD2' HG13 ' A' ' 81' ' ' VAL . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -68.02 130.15 20.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -63.11 114.72 3.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.437 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.673 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -117.22 161.93 18.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.293 -179.493 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CD2' HG22 ' A' ' 40' ' ' VAL . 25.4 m-70 -115.51 124.76 51.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.6 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 8' ' ' ILE . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.618 ' HB3' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.403 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.618 HG13 ' HB3' ' A' ' 93' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG23 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.738 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HD3' HG21 ' B' ' 98' ' ' VAL . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.599 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.733 HD23 ' CD1' ' A' ' 48' ' ' LEU . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.81 HD11 HG21 ' A' ' 18' ' ' ILE . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 48' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -63.82 1.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.52 -30.92 67.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -65.42 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.149 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.857 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -88.8 -44.84 10.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -28.62 68.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.058 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -31.88 66.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.034 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -59.77 4.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.856 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.409 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -79.06 134.97 36.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.76 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.9 165.16 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.016 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -96.08 162.05 13.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 48' ' ' LEU . 10.7 p -127.79 130.54 70.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.132 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.06 99.12 3.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.33 150.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.911 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -142.53 -159.73 8.06 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -131.27 139.29 49.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -136.46 119.71 16.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.169 179.991 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.488 1.186 0 CA-C-O 120.827 0.261 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -109.28 -28.3 9.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.921 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.4 p-80 -151.71 49.67 0.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.791 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.434 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.747 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.698 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.853 ' O ' HG12 ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.871 HG11 ' CD ' ' A' ' 36' ' ' LYS . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.698 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.443 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.747 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.625 HG13 HD12 ' A' ' 27' ' ' LEU . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.549 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.457 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.472 ' HG2' HG22 ' A' ' 41' ' ' VAL . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.625 HD12 HG13 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.871 ' CD ' HG11 ' A' ' 12' ' ' VAL . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.878 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 44' ' ' THR . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.485 HG23 ' HB ' ' A' ' 41' ' ' VAL . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.878 HD11 HG13 ' A' ' 40' ' ' VAL . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.43 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.731 HD12 HD13 ' A' ' 62' ' ' LEU . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.811 ' HA ' HG23 ' B' ' 98' ' ' VAL . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . -138.63 152.32 48.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' CE2' ' B' ' 95' ' ' PHE . 47.6 p -86.94 99.41 1.13 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -48.75 163.69 0.27 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.471 2.78 . . . . 0.0 112.3 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.51 -17.82 15.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.404 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.2 m -71.36 -21.16 62.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -95.48 121.89 37.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.83 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.94 -22.84 50.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.198 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.17 116.99 29.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp -96.22 106.2 18.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.405 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.425 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.731 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 86' ' ' ARG . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -56.42 148.66 18.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.751 HG13 ' H ' ' A' ' 67' ' ' ASP . 7.1 p -97.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.753 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.751 ' H ' HG13 ' A' ' 66' ' ' VAL . 4.7 t0 76.77 -179.3 0.14 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.347 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 81' ' ' VAL . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.813 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 71' ' ' LYS . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.813 ' HD3' HG23 ' A' ' 80' ' ' VAL . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.06 146.45 87.26 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -60.15 121.87 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.566 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.598 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -127.05 159.14 35.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.217 -179.639 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.411 ' CE1' HG22 ' A' ' 40' ' ' VAL . 17.4 m80 -111.66 120.74 43.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.551 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.537 ' O ' HD12 ' A' ' 8' ' ' ILE . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.539 ' HD2' HG22 ' A' ' 96' ' ' VAL . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.662 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.662 HG12 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.503 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.603 HG23 HD13 ' A' ' 104' ' ' LEU . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.921 HG21 ' HA ' ' A' ' 3' ' ' HIS . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.603 HD13 HG23 ' A' ' 100' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.534 HD11 HG21 ' A' ' 18' ' ' ILE . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.613 HD11 ' HB2' ' A' ' 48' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.445 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.445 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -68.13 0.24 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.42 -30.74 68.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.963 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.09 -59.46 3.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.935 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 90' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' B' ' 91' ' ' ASP . 50.3 p90 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.779 0.324 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' ASP . . . . . 0.43 ' HB2' ' CE1' ' B' ' 90' ' ' TYR . 9.1 t0 -89.89 -69.6 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 95.2 p -110.26 -31.85 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.952 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -60.83 -29.12 69.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -84.04 -30.05 26.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.562 ' CE2' HG23 ' A' ' 51' ' ' THR . 1.2 t80 -167.53 135.0 2.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.97 131.54 54.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.99 145.93 25.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.811 HG23 ' HA ' ' A' ' 49' ' ' GLN . 2.6 t -96.27 166.12 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.732 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.484 ' H ' HG12 ' B' ' 98' ' ' VAL . 13.2 t -47.0 161.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.869 0.366 . . . . 0.0 111.265 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -127.79 -48.02 1.38 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 155.64 68.29 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.43 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -115.56 109.51 17.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -109.31 34.38 3.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.937 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.613 HG13 ' O ' ' B' ' 104' ' ' VAL . 7.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.489 1.211 0 CA-C-O 120.948 0.312 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.8 p -114.85 -48.2 2.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.817 ' HA ' HG21 ' A' ' 103' ' ' THR . 37.1 p-80 -115.51 40.39 2.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.712 ' HB3' HG13 ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.714 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.88 ' O ' HG12 ' A' ' 12' ' ' VAL . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.88 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.712 HG13 ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.562 HG21 HD11 ' A' ' 107' ' ' ILE . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.588 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.588 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.641 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.564 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.834 ' HD2' HG11 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.685 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 108' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.685 HD11 HG13 ' A' ' 40' ' ' VAL . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.508 HD21 ' CD2' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.405 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -148.42 131.99 16.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -59.81 103.71 0.39 Allowed Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.29 163.68 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.435 2.756 . . . . 0.0 112.275 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.61 -19.13 9.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.361 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -21.39 50.46 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.5 m -90.17 114.66 26.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.984 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.6 -23.22 66.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.116 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.571 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -90.72 127.9 36.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp -94.15 105.92 17.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HE3' ' CE1' ' B' ' 95' ' ' PHE . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 97' ' ' MET . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -85.76 141.57 29.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.982 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -77.85 -8.64 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-O 121.996 0.903 . . . . 0.0 111.296 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 60.69 -175.06 0.12 Allowed 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.755 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' CG ' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.945 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.472 HG13 HG11 ' A' ' 66' ' ' VAL . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.982 ' HA ' HG23 ' A' ' 66' ' ' VAL . 88.8 Cg_endo -81.81 140.95 11.81 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -59.81 115.52 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.464 ' CB ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -131.3 162.47 29.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.925 0.393 . . . . 0.0 111.456 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -116.69 151.25 36.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.522 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.58 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.77 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.77 HG12 ' HB3' ' A' ' 93' ' ' ASN . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.512 ' HG3' HD11 ' A' ' 60' ' ' LEU . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.58 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.817 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.564 HD11 ' CD1' ' A' ' 27' ' ' LEU . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.592 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.6 mm100 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -70.9 -59.8 2.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -57.96 -31.2 66.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.9 64.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.92 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.736 0.303 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.95 -31.3 17.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.934 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.2 t -96.45 -31.17 12.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -60.12 -31.5 70.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.901 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -88.41 -62.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.47 ' CE1' ' HE3' ' A' ' 59' ' ' MET . 5.4 m-85 -78.77 135.03 36.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.708 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.83 154.87 18.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -90.31 162.02 15.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.0 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.574 ' O ' HG13 ' B' ' 98' ' ' VAL . 10.2 p -139.23 111.2 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.475 HG22 ' H ' ' B' ' 100' ' ' ASP . 0.2 OUTLIER -147.03 -177.52 5.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ASP . . . . . 0.475 ' H ' HG22 ' B' ' 99' ' ' THR . 2.1 m-20 -154.93 77.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.93 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.63 103.41 2.54 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.61 172.58 11.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.786 0.327 . . . . 0.0 110.924 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.11 84.69 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.113 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.199 0 CA-C-O 120.946 0.311 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 t -95.39 -43.38 8.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.843 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.4 m80 -105.64 38.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.935 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.777 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 13' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.783 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.794 HG21 ' CD ' ' A' ' 36' ' ' LYS . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.734 ' HA ' HD12 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.777 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.778 HG11 ' OE1' ' A' ' 26' ' ' GLU . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.459 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.778 ' OE1' HG11 ' A' ' 22' ' ' VAL . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.613 HD12 HG13 ' A' ' 18' ' ' ILE . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.611 HG21 ' NH1' ' A' ' 30' ' ' ARG . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.414 ' CH2' HG13 ' A' ' 12' ' ' VAL . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.611 ' NH1' HG21 ' A' ' 28' ' ' THR . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.794 ' CD ' HG21 ' A' ' 12' ' ' VAL . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.476 HG22 ' HG2' ' A' ' 26' ' ' GLU . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.445 ' HB3' HG12 ' A' ' 41' ' ' VAL . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.77 HD23 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.411 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.452 ' HA ' HD12 ' A' ' 60' ' ' LEU . . . -129.02 132.47 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.51 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 41.3 p -88.1 99.27 1.29 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.059 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.47 163.73 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 123.4 2.733 . . . . 0.0 112.37 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.87 -15.73 14.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.428 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.2 -21.43 62.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.749 0.309 . . . . 0.0 111.174 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 m -92.92 125.67 37.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.836 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.98 -25.61 63.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.01 115.15 29.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp -95.27 106.06 18.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.78 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.447 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.495 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HG3' ' HE3' ' A' ' 88' ' ' MET . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.559 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.475 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -77.87 137.26 38.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.782 HG21 ' O ' ' A' ' 82' ' ' PRO . 12.0 p -105.0 -123.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.106 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.68 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.8 m-20 -177.44 119.95 0.11 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.82 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.434 ' O ' HG13 ' A' ' 80' ' ' VAL . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' ASN . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.782 ' O ' HG21 ' A' ' 66' ' ' VAL . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.414 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 72.1 Cg_endo -74.88 -176.31 2.78 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -80.04 115.36 19.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -106.62 116.36 31.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.508 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -93.15 111.7 23.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.541 ' HE3' ' HG3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.436 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.627 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.627 HG12 ' CB ' ' A' ' 93' ' ' ASN . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.461 ' N ' HG13 ' A' ' 96' ' ' VAL . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.597 HD12 ' CG2' ' A' ' 16' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD22 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.843 HG21 ' HA ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.77 ' HB3' HD23 ' A' ' 48' ' ' LEU . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.8 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.449 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -55.7 -67.01 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -31.31 69.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.926 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.58 -43.02 77.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.085 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.872 -179.97 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.852 0.358 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 91' ' ' ASP . . . . . 0.407 ' HB2' ' CE2' ' B' ' 95' ' ' PHE . 1.6 p30 -60.02 -31.57 70.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -34.72 76.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.23 28.79 8.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -119.99 -41.87 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.904 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.447 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 1.6 m-85 -94.49 144.19 25.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -93.94 149.6 21.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -96.1 150.07 20.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.174 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.641 ' HB ' HD12 ' A' ' 48' ' ' LEU . 34.3 t -99.99 163.96 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.537 ' N ' HG12 ' B' ' 98' ' ' VAL . 14.5 t -46.67 146.17 1.64 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.844 0.355 . . . . 0.0 111.39 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -151.71 -174.01 4.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.9 170.98 44.49 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.57 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -141.67 76.06 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.68 147.02 46.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.121 179.975 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.192 0 CA-C-O 120.887 0.286 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -95.93 -30.67 13.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.891 ' HA ' HG21 ' A' ' 103' ' ' THR . 13.4 m80 -97.38 38.84 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.746 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.683 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.556 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.556 HD13 ' O ' ' A' ' 14' ' ' GLY . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.746 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.509 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.555 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.555 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.753 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.408 ' HD1' HG13 ' A' ' 16' ' ' ILE . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.875 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 107' ' ' ILE . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.875 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.024 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.8 131.45 13.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.6 HG23 ' O ' ' A' ' 59' ' ' MET . 53.4 p -54.24 102.79 0.33 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.307 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -47.6 163.76 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.417 2.745 . . . . 0.0 112.334 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.92 -17.6 6.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.516 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -71.2 -21.09 62.19 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.747 0.308 . . . . 0.0 111.13 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.32 130.17 54.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.797 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.36 -19.82 52.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.85 117.75 23.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.082 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.99 111.95 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.769 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.6 ' O ' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.736 HD11 ' HG3' ' A' ' 97' ' ' MET . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 141.02 49.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.756 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.2 p -106.51 -123.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.149 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.68 ' H ' HG13 ' A' ' 66' ' ' VAL . 1.7 p30 -176.32 132.46 0.23 Allowed 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.756 ' O ' HG21 ' A' ' 66' ' ' VAL . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -75.68 -168.47 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -86.31 115.62 23.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.644 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -100.48 110.18 22.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -93.27 113.38 25.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.547 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.561 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.553 ' CD1' HD13 ' A' ' 60' ' ' LEU . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.805 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' ASN . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.736 ' HG3' HD11 ' A' ' 60' ' ' LEU . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.526 HG23 HD13 ' A' ' 104' ' ' LEU . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HD2' HG11 ' B' ' 98' ' ' VAL . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' ' 48' ' ' LEU . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.802 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 1.024 HD11 HD13 ' A' ' 48' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -53.21 60.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.23 -31.72 71.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.31 -61.16 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.886 -179.966 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 90' ' ' TYR . . . . . 0.401 ' CE1' ' OD2' ' B' ' 91' ' ' ASP . 30.3 p90 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.771 0.32 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' ASP . . . . . 0.401 ' OD2' ' CE1' ' B' ' 90' ' ' TYR . 10.4 m-20 -67.17 -31.51 71.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 13.2 p -63.77 -37.91 89.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -77.32 -31.12 54.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.953 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.93 -31.46 72.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.442 ' CE1' ' CE ' ' A' ' 59' ' ' MET . 13.2 m-85 -142.41 134.92 27.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.858 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -102.89 168.62 9.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.004 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -96.07 162.06 13.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.557 HG22 ' HB3' ' A' ' 48' ' ' LEU . 35.6 m -108.43 115.13 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.68 133.04 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -78.06 -170.71 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -158.0 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -147.25 156.0 42.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 110.921 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 60.91 156.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.126 -179.96 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.488 1.174 0 CA-C-O 120.806 0.252 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -104.1 -54.58 2.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.878 ' HA ' HG21 ' A' ' 103' ' ' THR . 6.0 m80 -98.35 38.72 1.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.913 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.411 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.79 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.79 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.534 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.635 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.464 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.755 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.72 HD12 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' N ' HD22 ' A' ' 48' ' ' LEU . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.56 132.02 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 p -88.08 99.42 1.36 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.092 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -48.18 163.64 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.377 2.718 . . . . 0.0 112.284 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -17.29 8.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.511 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.08 -20.86 62.31 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.796 0.331 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.82 128.91 37.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.73 -26.87 68.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.061 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -100.17 115.36 29.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.695 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp -92.68 105.83 17.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.913 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.68 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.57 HD13 ' CB ' ' A' ' 86' ' ' ARG . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -68.36 138.83 55.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.684 HG13 ' H ' ' A' ' 67' ' ' ASP . 14.3 p -108.73 -124.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.034 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.684 ' H ' HG13 ' A' ' 66' ' ' VAL . 7.2 t70 -173.71 149.59 1.62 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.888 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.44 130.66 12.02 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -57.21 114.5 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.519 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.57 ' CB ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.58 153.87 46.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.275 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.471 ' CD2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 -110.6 116.75 31.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.483 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.68 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.886 ' HB3' HG12 ' A' ' 96' ' ' VAL . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.886 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.511 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.602 ' CG2' HD13 ' A' ' 104' ' ' LEU . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.878 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.602 HD13 ' CG2' ' A' ' 100' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 103' ' ' THR . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 48' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 25' ' ' ALA . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -60.35 -50.59 73.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -60.37 -31.73 70.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.67 -34.58 60.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.863 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.794 0.331 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.62 -51.01 9.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.904 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -78.11 -31.26 49.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.9 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.45 29.06 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.86 -63.01 1.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.922 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.448 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 54.8 m-85 -84.66 137.55 33.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.861 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -93.92 157.13 16.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.014 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -95.94 162.05 13.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.543 HG23 HD11 ' A' ' 48' ' ' LEU . 34.2 m -107.21 116.87 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.03 162.41 38.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.39 118.43 6.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.948 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.66 -62.69 0.38 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 62.83 -79.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.739 0.304 . . . . 0.0 111.025 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -154.11 -74.4 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.963 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 27.6 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.041 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.485 1.027 0 CA-C-O 120.989 0.329 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 t -70.04 -68.87 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.892 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.89 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -86.53 53.89 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.163 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.756 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.438 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.813 ' O ' HG12 ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.813 HG12 ' O ' ' A' ' 9' ' ' PHE . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.564 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.756 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.783 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 26' ' ' GLU . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.429 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.711 ' HE2' HG11 ' A' ' 12' ' ' VAL . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.811 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.517 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.811 HD11 HG13 ' A' ' 40' ' ' VAL . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.566 ' HB3' HG22 ' A' ' 63' ' ' ILE . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 62' ' ' LEU . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -153.53 134.39 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.739 HG22 ' O ' ' B' ' 94' ' ' GLU . 0.7 OUTLIER -57.34 149.2 49.83 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.218 0.532 . . . . 0.0 111.169 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -84.97 164.32 11.64 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.882 3.055 . . . . 0.0 112.222 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.2 -6.66 4.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.153 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -90.92 -21.47 21.35 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.764 0.316 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.0 t -84.28 129.48 34.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.44 -24.92 60.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.104 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 51' ' ' THR . 14.2 mmmt -102.28 114.39 28.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.49 118.31 21.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.903 HD13 ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.448 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 46' ' ' ASP . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.502 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.76 131.04 57.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.934 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -86.99 -5.4 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 122.261 1.029 . . . . 0.0 110.7 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 42.21 29.9 0.17 Allowed 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.619 -1.628 . . . . 0.0 112.062 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.4 ' CD ' ' HG3' ' A' ' 82' ' ' PRO . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' HG13 ' A' ' 80' ' ' VAL . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 78' ' ' ASN . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.49 ' O ' HG21 ' A' ' 66' ' ' VAL . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.408 ' CB ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.934 ' HA ' HG23 ' A' ' 66' ' ' VAL . 35.3 Cg_endo -63.41 167.68 12.6 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.99 114.98 4.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.353 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -104.25 115.85 31.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.303 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.543 ' CD2' HG22 ' A' ' 40' ' ' VAL . 37.3 m-70 -103.18 111.17 23.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.903 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.539 ' HB3' HG12 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.728 HG13 ' HD2' ' A' ' 91' ' ' PHE . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.465 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.607 HD12 ' CG2' ' A' ' 16' ' ' ILE . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' HD21 ' A' ' 48' ' ' LEU . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.503 ' O ' ' NE2' ' A' ' 106' ' ' GLN . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.89 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.712 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.406 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.503 ' NE2' ' O ' ' A' ' 102' ' ' MET . 1.8 mp0 -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.783 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp -58.73 -44.18 90.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -31.21 69.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.08 -34.38 16.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.162 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.948 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.731 0.301 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -89.67 -31.71 17.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 3.8 m -87.23 -31.34 20.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -98.42 28.99 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' GLU . . . . . 0.739 ' O ' HG22 ' A' ' 51' ' ' THR . 12.7 pt-20 -88.3 -33.71 17.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.873 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.18 137.64 40.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.91 166.64 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -96.01 161.97 13.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.016 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.466 HG12 ' N ' ' B' ' 99' ' ' THR . 4.8 t -137.91 163.45 29.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.466 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.0 t -47.46 127.86 11.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.185 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.26 -54.38 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -156.72 108.03 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -60.49 145.64 47.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.845 0.355 . . . . 0.0 110.92 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -169.66 164.48 10.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.114 179.968 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.487 1.141 0 CA-C-O 120.841 0.267 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -116.77 -52.5 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.908 ' HA ' HG21 ' A' ' 103' ' ' THR . 9.2 m80 -105.65 38.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.517 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.768 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.575 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.865 ' O ' HG12 ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.497 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.497 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.768 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.561 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.533 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HG12 ' A' ' 16' ' ' ILE . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.442 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.401 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HE3' HG21 ' A' ' 63' ' ' ILE . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.601 HE22 HD11 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.72 134.76 23.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.469 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 8.9 p -44.59 99.59 0.21 Allowed Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.597 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -48.72 163.65 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 123.455 2.77 . . . . 0.0 112.208 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.83 -18.37 12.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.402 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -81.84 -21.37 37.63 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.738 0.304 . . . . 0.0 111.187 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -86.82 136.95 32.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -89.36 -19.53 25.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.4 ' N ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 167.15 17.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.86 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp -122.5 105.77 10.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.72 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.848 HD11 ' HG3' ' A' ' 97' ' ' MET . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.465 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.601 HD11 HE22 ' A' ' 49' ' ' GLN . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.22 138.34 33.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.913 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -104.15 -8.16 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 CA-C-O 122.073 0.94 . . . . 0.0 111.276 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 62.93 131.82 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.715 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 80' ' ' VAL . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 78' ' ' ASN . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.877 ' O ' HG21 ' A' ' 66' ' ' VAL . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.913 ' HA ' HG23 ' A' ' 66' ' ' VAL . 73.4 Cg_endo -74.11 128.19 12.0 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -58.19 115.0 2.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.379 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -129.08 160.56 32.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.128 0.489 . . . . 0.0 111.618 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 -125.43 128.85 48.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.304 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.757 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.804 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.6 OUTLIER -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.804 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.848 ' HG3' HD11 ' A' ' 60' ' ' LEU . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.605 HG23 HD13 ' A' ' 104' ' ' LEU . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.908 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.605 HD13 HG23 ' A' ' 100' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.561 ' CD1' HG21 ' A' ' 18' ' ' ILE . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.9 -67.32 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -37.71 88.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.915 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.55 -36.09 82.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.12 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.4 t0 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.883 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.824 0.345 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.29 -67.95 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -96.96 -63.76 1.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.842 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.96 -66.81 0.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -120.04 -42.12 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 51' ' ' THR . 3.8 t80 -168.97 170.56 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.814 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.92 146.24 24.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.056 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -91.4 162.07 14.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.572 HG23 ' HA ' ' A' ' 49' ' ' GLN . 34.4 t -128.94 103.96 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.094 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.01 101.99 3.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -156.81 -50.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.61 64.84 3.65 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.487 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.6 t30 59.94 84.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.811 0.339 . . . . 0.0 110.94 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 64.86 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.872 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.099 -179.983 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.895 0.29 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -108.91 -29.7 8.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.974 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.954 ' HA ' HG21 ' A' ' 103' ' ' THR . 2.5 p-80 -161.2 48.56 0.22 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.758 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.787 ' O ' HG12 ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.787 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.758 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.585 HG21 HD11 ' A' ' 107' ' ' ILE . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.588 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' HG21 ' A' ' 22' ' ' VAL . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.719 ' CE ' HG11 ' A' ' 12' ' ' VAL . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.73 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 108' ' ' ILE . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.414 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.73 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' HG3' HG13 ' A' ' 63' ' ' ILE . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.6 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -138.99 145.53 39.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -77.65 102.27 0.86 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.094 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.525 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.09 163.62 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.433 2.756 . . . . 0.0 112.334 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.72 -14.12 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.407 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 t -86.26 -18.49 31.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.752 0.31 . . . . 0.0 111.2 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.95 133.5 41.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -71.6 -31.4 66.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.891 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.468 ' O ' HG21 ' A' ' 51' ' ' THR . 18.0 mmmt -102.5 140.17 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.721 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp -101.55 105.94 16.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.803 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.4 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.509 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp -60.65 139.56 57.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.7 HG13 ' H ' ' A' ' 67' ' ' ASP . 13.7 p -106.29 -124.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.147 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG13 ' A' ' 66' ' ' VAL . 4.9 t0 -179.4 145.6 0.25 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.405 HG13 ' HD2' ' A' ' 82' ' ' PRO . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' O ' HG21 ' A' ' 66' ' ' VAL . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 57.1 Cg_endo -69.92 -178.31 2.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -81.12 115.08 20.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.384 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -107.48 116.7 32.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.436 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -93.23 116.95 29.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.187 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.592 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB2' HG12 ' A' ' 96' ' ' VAL . 5.1 m120 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.704 HG12 ' HB2' ' A' ' 93' ' ' ASN . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.954 HG21 ' HA ' ' A' ' 3' ' ' HIS . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.717 HD11 ' CD1' ' A' ' 27' ' ' LEU . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.575 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 16.8 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm100 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 103' ' ' THR . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD11 HD12 ' A' ' 42' ' ' LEU . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -69.83 -63.06 1.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.24 -31.67 70.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.2 -61.35 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.113 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.5 t0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.879 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.31 -40.11 89.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -32.43 71.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 28.98 7.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -119.9 25.03 10.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.434 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -168.93 134.98 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.871 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.37 164.54 27.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -95.99 161.83 13.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.937 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.533 ' O ' HG13 ' B' ' 98' ' ' VAL . 10.8 p -141.65 115.39 4.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.025 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 99' ' ' THR . . . . . 0.445 HG22 ' H ' ' B' ' 100' ' ' ASP . 0.2 OUTLIER -145.73 178.92 7.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.914 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 100' ' ' ASP . . . . . 0.445 ' H ' HG22 ' B' ' 99' ' ' THR . 1.4 m-20 -132.87 172.42 12.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 159.1 -103.35 0.23 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.557 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 60.54 34.84 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.944 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.07 -61.46 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.157 -0.925 . . . . 0.0 111.073 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.179 0 CA-C-O 120.859 0.275 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -103.26 -48.35 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.803 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.9 m80 -98.03 37.87 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.783 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.892 ' O ' HG12 ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.781 ' HA ' HD12 ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.783 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.562 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.562 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.719 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.852 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG22 ' CD ' ' A' ' 26' ' ' GLU . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.852 HD11 HG13 ' A' ' 40' ' ' VAL . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.87 HD21 ' HA ' ' A' ' 101' ' ' LYS . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.492 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . -140.5 138.01 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 59' ' ' MET . 12.0 p -84.94 99.57 0.89 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.134 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -48.2 163.67 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.401 2.734 . . . . 0.0 112.295 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.66 -13.89 26.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.471 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -71.24 -21.52 62.1 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.741 0.305 . . . . 0.0 111.212 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -92.59 129.24 38.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.26 -28.29 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.94 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -95.43 159.53 14.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.658 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp -130.13 105.69 8.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.165 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.51 ' O ' HG23 ' A' ' 51' ' ' THR . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.69 141.89 53.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.726 HG13 ' H ' ' A' ' 67' ' ' ASP . 14.9 p -106.81 -124.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.153 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.726 ' H ' HG13 ' A' ' 66' ' ' VAL . 9.2 t0 -164.52 107.68 0.9 Allowed 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.819 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.477 ' O ' HG13 ' A' ' 80' ' ' VAL . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 57.1 Cg_endo -69.84 -176.86 1.65 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -73.65 114.8 12.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -108.13 114.9 29.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.478 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.668 ' CE1' HG22 ' A' ' 40' ' ' VAL . 31.8 m80 -93.36 111.25 22.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.049 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.421 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.595 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.595 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.506 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.572 HG23 HD13 ' A' ' 104' ' ' LEU . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.87 ' HA ' HD21 ' A' ' 48' ' ' LEU . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.803 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.719 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' A' ' 18' ' ' ILE . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 107' ' ' ILE . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -67.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.55 -31.6 69.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.47 -33.72 71.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.942 179.928 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.86 -30.68 40.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -59.43 -29.25 67.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -58.94 -55.71 31.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.26 -63.11 1.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -72.88 135.07 45.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.822 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -118.63 141.45 48.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.0 162.05 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.852 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -126.01 108.14 18.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.147 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.05 -176.26 5.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.59 81.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -137.45 -88.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.466 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.4 t30 60.71 172.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -167.48 146.23 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.924 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.098 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.815 0.256 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -105.65 -30.82 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.534 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.2 p-80 -149.34 47.5 0.97 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.744 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.685 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.884 HG11 ' HD3' ' A' ' 36' ' ' LYS . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.685 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.744 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.58 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.719 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.499 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.884 ' HD3' HG11 ' A' ' 12' ' ' VAL . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.867 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.867 HD11 HG13 ' A' ' 40' ' ' VAL . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.076 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.403 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -149.08 131.33 15.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.625 HG21 ' O ' ' A' ' 57' ' ' LYS . 2.8 p -57.87 103.38 0.36 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.197 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.39 163.72 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.334 2.689 . . . . 0.0 112.295 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.75 -18.32 12.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.383 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -74.77 -21.43 59.33 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.765 0.317 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.9 t -102.11 108.64 20.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.919 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -59.1 -21.34 59.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.625 ' O ' HG21 ' A' ' 51' ' ' THR . 11.3 mmmt -84.04 115.1 22.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.85 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' SD ' ' A' ' 97' ' ' MET . 1.4 mtp -80.87 117.04 21.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.832 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.531 ' HE2' ' CE1' ' B' ' 95' ' ' PHE . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 97' ' ' MET . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HG2' ' HE3' ' A' ' 88' ' ' MET . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.539 HD11 HG21 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 142.25 58.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.821 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.0 p -107.0 -124.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.994 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.694 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.0 p30 -176.7 141.93 0.4 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.916 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 80' ' ' VAL . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 78' ' ' ASN . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.821 ' O ' HG21 ' A' ' 66' ' ' VAL . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.12 167.92 25.03 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.18 175.95 0.37 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.535 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB3' ' CD1' ' A' ' 63' ' ' ILE . 7.5 ptt180 -166.97 109.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.861 0.362 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -93.03 122.24 35.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.336 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.443 ' HE3' ' HG2' ' A' ' 61' ' ' ARG . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 8' ' ' ILE . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.56 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.56 HG12 ' CB ' ' A' ' 93' ' ' ASN . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.496 HG22 HD22 ' A' ' 104' ' ' LEU . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.58 ' HG2' HG21 ' B' ' 98' ' ' VAL . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 107' ' ' ILE . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.601 ' CD2' HD21 ' A' ' 48' ' ' LEU . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 108' ' ' ILE . 15.7 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.719 HG23 ' HB3' ' A' ' 25' ' ' ALA . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 1.076 HD11 HD13 ' A' ' 48' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -64.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.966 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.51 -39.41 64.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.136 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.915 179.966 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.761 0.315 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -60.35 -31.77 70.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.5 t -98.17 3.96 49.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.415 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -98.69 29.06 3.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.09 -56.24 5.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.867 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.531 ' CE1' ' HE2' ' A' ' 59' ' ' MET . 3.2 m-85 -82.35 135.01 35.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.785 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -108.93 159.24 16.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.045 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -96.03 161.98 13.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.938 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.58 HG21 ' HG2' ' A' ' 101' ' ' LYS . 35.9 m -121.65 111.91 32.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 157.12 43.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.925 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -109.9 -48.14 3.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.45 143.2 0.47 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -139.88 107.21 5.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -107.97 141.32 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.915 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.151 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 120.839 0.266 . . . . 0.0 111.768 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -67.57 -39.89 84.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.758 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -92.39 46.79 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.141 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.753 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.59 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.867 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.867 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.753 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.788 HG21 HD11 ' A' ' 107' ' ' ILE . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.598 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.598 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.739 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.847 ' CD ' HG11 ' A' ' 12' ' ' VAL . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.952 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 104' ' ' LEU . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.43 ' HA ' ' CE1' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.952 HD11 HG13 ' A' ' 40' ' ' VAL . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' H ' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.506 ' NE2' ' CB ' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -161.56 132.16 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.492 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -54.13 102.55 0.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.359 -179.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.6 Cg_endo -48.51 163.66 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 123.359 2.706 . . . . 0.0 112.264 178.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.41 -14.34 27.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.426 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.39 -21.45 45.67 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.731 0.301 . . . . 0.0 111.257 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 m -95.52 127.19 41.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.96 63.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.421 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.82 140.27 32.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.827 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm -108.72 105.97 15.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.901 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.456 ' C ' HD12 ' A' ' 60' ' ' LEU . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.999 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.506 ' CB ' ' NE2' ' A' ' 49' ' ' GLN . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.586 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.473 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 138.49 58.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.2 p -105.02 -123.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.131 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.682 ' H ' HG13 ' A' ' 66' ' ' VAL . 6.1 t0 -179.94 104.09 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.489 ' O ' HG13 ' A' ' 80' ' ' VAL . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.489 HG13 ' O ' ' A' ' 78' ' ' ASN . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 58.6 Cg_endo -70.76 -172.78 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -86.88 115.06 24.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.613 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HG3' HD13 ' A' ' 63' ' ' ILE . 7.1 ttt180 -107.44 109.46 21.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.268 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -94.14 114.04 26.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.417 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 8' ' ' ILE . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.999 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 96' ' ' VAL . 0.6 OUTLIER -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.745 HG13 ' HD2' ' A' ' 91' ' ' PHE . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.533 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.794 ' CD1' HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.444 ' NE2' ' HA ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.788 HD11 HG21 ' A' ' 18' ' ' ILE . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.794 HD11 ' CD1' ' A' ' 104' ' ' LEU . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt -134.0 -66.11 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -31.84 72.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.86 -52.87 31.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.928 -179.988 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.341 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -90.2 15.04 11.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.6 m -98.62 -31.34 11.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.81 0.338 . . . . 0.0 110.919 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.67 -60.13 4.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.05 -49.79 40.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.955 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.433 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -101.1 135.09 43.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.881 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -139.9 138.07 35.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.911 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -74.88 155.12 37.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.9 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.592 ' O ' HG23 ' B' ' 98' ' ' VAL . 27.1 m -135.43 109.18 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.08 126.14 12.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.9 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -100.8 -169.94 1.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -171.43 -103.87 0.17 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.472 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -174.65 79.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.81 0.338 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.16 142.28 31.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.067 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.487 1.129 0 CA-C-O 120.914 0.298 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -67.79 -67.21 0.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.966 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.914 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -89.3 50.62 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.1 -179.962 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.73 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.835 ' O ' HG12 ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.73 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG23 ' A' ' 16' ' ' ILE . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.723 ' CE ' HG11 ' A' ' 12' ' ' VAL . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.731 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.731 HD11 HG13 ' A' ' 40' ' ' VAL . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HG3' ' CG1' ' A' ' 63' ' ' ILE . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.706 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HA ' HG23 ' B' ' 98' ' ' VAL . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.57 131.76 12.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.704 HG21 ' O ' ' A' ' 57' ' ' LYS . 1.2 p -58.07 103.6 0.37 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.5 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -47.82 163.73 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 123.304 2.669 . . . . 0.0 112.358 179.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.43 -20.2 4.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.446 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.4 p -76.58 -21.29 55.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.8 m -92.8 115.28 27.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.13 -22.19 64.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.1 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.704 ' O ' HG21 ' A' ' 51' ' ' THR . 22.1 mmmt -88.6 114.8 25.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.884 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.7 106.24 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' A' ' 101' ' ' LYS . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' NE ' ' CD2' ' B' ' 95' ' ' PHE . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.14 142.59 58.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.719 HG11 ' CG1' ' A' ' 81' ' ' VAL . 12.1 p -104.86 -123.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 CA-C-O 120.984 0.421 . . . . 0.0 110.054 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.688 ' H ' HG13 ' A' ' 66' ' ' VAL . 1.4 m-20 -145.62 101.8 3.61 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.877 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 80' ' ' VAL . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.719 ' CG1' HG11 ' A' ' 66' ' ' VAL . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' A' ' 81' ' ' VAL . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -74.13 140.88 28.65 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -64.13 115.33 4.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.483 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HB3' HD13 ' A' ' 63' ' ' ILE . 17.5 ptt85 -124.69 174.87 7.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.219 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 -130.65 126.91 37.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.676 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.498 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HD2' HG22 ' A' ' 96' ' ' VAL . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.639 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.639 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.517 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.619 HG23 HD13 ' A' ' 104' ' ' LEU . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.501 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.514 ' O ' ' NE2' ' A' ' 106' ' ' GLN . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.914 HG21 ' HA ' ' A' ' 3' ' ' HIS . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.706 ' CB ' HD21 ' A' ' 48' ' ' LEU . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 102' ' ' MET . 1.8 mp0 -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.441 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.705 HD11 ' CD1' ' A' ' 48' ' ' LEU . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -70.98 -54.55 10.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.97 -31.49 68.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.953 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.63 -30.46 36.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.893 179.985 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.782 0.325 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -68.42 -30.94 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.64 -30.43 68.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.918 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.06 -30.73 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -76.77 -31.32 56.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CD2' ' NE ' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -95.28 134.98 37.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -102.16 162.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.94 162.04 13.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.556 HG23 ' HA ' ' A' ' 49' ' ' GLN . 32.3 t -132.8 103.87 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.086 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.16 107.4 4.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.909 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.43 165.76 4.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 109.62 -104.05 1.83 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.532 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.68 166.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.852 0.358 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -132.73 123.03 25.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.161 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 120.823 0.259 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.03 -49.39 3.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.5 ' HA ' HG21 ' A' ' 103' ' ' THR . 15.3 m80 -97.88 38.44 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.775 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.668 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.668 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.775 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.785 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.768 HG21 ' HG3' ' A' ' 26' ' ' GLU . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.469 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.768 ' HG3' HG21 ' A' ' 22' ' ' VAL . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.818 ' HD2' HG11 ' A' ' 12' ' ' VAL . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.512 HG22 ' HG2' ' A' ' 26' ' ' GLU . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.44 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.948 HD23 HG11 ' B' ' 98' ' ' VAL . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.22 134.8 17.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.534 HG23 ' O ' ' A' ' 59' ' ' MET . 39.4 p -84.31 99.57 0.83 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.037 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.1 Cg_endo -47.38 163.8 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.378 2.719 . . . . 0.0 112.353 179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.04 -18.1 4.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.483 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -71.29 -21.03 62.13 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.778 0.323 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -94.33 117.69 30.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.811 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -58.25 -22.86 53.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -99.0 115.03 28.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp -87.52 106.1 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.811 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.534 ' O ' HG23 ' A' ' 51' ' ' THR . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' C ' ' A' ' 59' ' ' MET . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.83 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.02 140.33 52.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 67' ' ' ASP . 15.0 p -109.17 -125.15 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.156 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.682 ' H ' HG13 ' A' ' 66' ' ' VAL . 7.0 p-10 -178.38 -175.03 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.758 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.95 122.87 7.5 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -56.95 114.91 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -128.53 166.68 18.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 9.5 m80 -127.25 131.0 50.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.499 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 8' ' ' ILE . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CD2' HG22 ' A' ' 96' ' ' VAL . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.689 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.689 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.497 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.403 ' O ' ' HE2' ' A' ' 102' ' ' MET . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.812 HG23 HD13 ' A' ' 104' ' ' LEU . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.403 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.564 ' CG2' HD13 ' A' ' 18' ' ' ILE . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.812 HD13 HG23 ' A' ' 100' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.785 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 48' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.68 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -73.62 -61.07 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.98 -38.64 83.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 110' ' ' ARG . . . -86.82 -68.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.106 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.4 t70 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.223 179.818 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.858 0.361 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -76.01 -32.35 59.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -63.82 -31.54 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.03 -32.24 73.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.04 -40.21 11.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.404 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -88.64 134.99 33.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.832 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -137.04 166.02 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.907 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.02 162.02 13.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.948 HG11 HD23 ' A' ' 48' ' ' LEU . 7.8 p -132.96 107.3 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.04 102.01 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.858 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -81.18 102.87 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.3 -156.93 21.63 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.477 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -121.08 105.11 10.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.775 0.321 . . . . 0.0 110.881 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -84.11 159.41 21.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.06 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.892 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.937 0.399 . . . . 0.0 111.14 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.833 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.833 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.647 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.433 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.716 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.599 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.872 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.805 ' HD2' HG11 ' A' ' 12' ' ' VAL . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.538 HG12 ' H ' ' A' ' 43' ' ' SER . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HG13 ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.538 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 1.031 HD12 ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.837 ' HE2' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.661 ' CD1' HD23 ' A' ' 104' ' ' LEU . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.836 0.35 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.595 HD13 ' CD1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.031 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.837 HG21 ' HE2' ' A' ' 47' ' ' LYS . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.824 0.345 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.516 ' O ' HG13 ' A' ' 80' ' ' VAL . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.401 ' NE2' HG22 ' A' ' 40' ' ' VAL . 4.8 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.688 0.28 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.448 ' HE3' ' CZ ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.573 ' O ' HD12 ' A' ' 8' ' ' ILE . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.595 ' CD1' HD13 ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.571 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.571 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.613 HG23 HD13 ' A' ' 104' ' ' LEU . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.892 HG21 ' HA ' ' A' ' 3' ' ' HIS . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.872 HD11 ' CD1' ' A' ' 27' ' ' LEU . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.584 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 42' ' ' LEU . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.584 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.936 ' HA ' HG21 ' A' ' 103' ' ' THR . 5.7 p-80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.796 0.331 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.431 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.664 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.861 ' O ' HG12 ' A' ' 12' ' ' VAL . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.443 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.861 HG12 ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.664 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.634 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.736 HG21 ' HG3' ' A' ' 26' ' ' GLU . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.445 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.613 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HG3' HG21 ' A' ' 22' ' ' VAL . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.58 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.772 ' CD ' HG11 ' A' ' 12' ' ' VAL . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.815 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.815 HD11 HG13 ' A' ' 40' ' ' VAL . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.434 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.428 ' HB3' ' HB2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.671 0.272 . . . . 0.0 111.102 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 60' ' ' LEU . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.733 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.4 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.769 0.318 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.447 ' O ' HG13 ' A' ' 80' ' ' VAL . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' ASN . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo . . . . . 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.776 0.322 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.534 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.733 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.782 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.567 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.936 HG21 ' HA ' ' A' ' 3' ' ' HIS . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.58 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.6 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.0 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.648 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.6 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.885 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.846 0.355 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.403 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.684 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.825 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.684 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.48 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.48 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.563 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.664 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.52 ' OE2' HG22 ' A' ' 41' ' ' VAL . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.603 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.44 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD2' HG11 ' A' ' 12' ' ' VAL . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.714 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.52 HG22 ' OE2' ' A' ' 26' ' ' GLU . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.714 HD11 HG13 ' A' ' 40' ' ' VAL . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.097 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.483 HE22 HD11 ' A' ' 63' ' ' ILE . 3.2 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB3' ' HD2' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.779 0.323 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.585 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.463 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.545 ' CD1' HD12 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.465 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.313 0.577 . . . . 0.0 111.443 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.808 ' HG3' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.808 HG22 ' HG3' ' A' ' 71' ' ' LYS . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 71' ' ' LYS . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.428 ' HG2' HG23 ' A' ' 63' ' ' ILE . 23.7 Cg_endo . . . . . 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.745 0.307 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.508 ' O ' HD12 ' A' ' 8' ' ' ILE . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HD2' HG13 ' A' ' 96' ' ' VAL . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.572 ' HB3' HG12 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.621 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.46 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.681 HG22 HD22 ' A' ' 104' ' ' LEU . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 3' ' ' HIS . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.681 HD22 HG22 ' A' ' 100' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.464 ' HA ' HD12 ' A' ' 108' ' ' ILE . 3.5 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.4 mm-40 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 1.097 HD11 HD13 ' A' ' 48' ' ' LEU . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.924 ' HA ' HG21 ' A' ' 103' ' ' THR . 40.9 p-80 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.788 0.327 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.75 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.75 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.497 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.656 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HG2' HG22 ' A' ' 41' ' ' VAL . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.633 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.449 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HD3' HG11 ' A' ' 12' ' ' VAL . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.625 HG13 HD11 ' A' ' 45' ' ' ILE . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.625 HD11 HG13 ' A' ' 40' ' ' VAL . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.643 ' CE ' HG21 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.552 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.72 0.295 . . . . 0.0 110.797 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.643 HG21 ' CE ' ' A' ' 47' ' ' LYS . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.833 0.349 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.415 HG13 ' HD2' ' A' ' 82' ' ' PRO . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.415 ' HD2' HG13 ' A' ' 81' ' ' VAL . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.528 ' CD2' HG22 ' A' ' 40' ' ' VAL . 22.6 m-70 . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.71 0.29 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 16' ' ' ILE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.545 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.759 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.759 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.447 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.41 ' N ' ' HG3' ' A' ' 97' ' ' MET . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.497 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.633 HD11 ' CD1' ' A' ' 27' ' ' LEU . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.585 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.826 HD12 ' O ' ' A' ' 103' ' ' THR . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.585 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.826 ' HA ' HG21 ' A' ' 103' ' ' THR . 14.5 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.838 0.351 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.864 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.469 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.55 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.561 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.561 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.451 ' HG2' HG22 ' A' ' 41' ' ' VAL . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.658 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.467 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 108' ' ' ILE . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.891 HD11 HG13 ' A' ' 40' ' ' VAL . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.43 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.747 0.308 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD11 ' HG3' ' A' ' 97' ' ' MET . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.796 0.331 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.433 HG13 ' HD2' ' A' ' 82' ' ' PRO . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD2' HG13 ' A' ' 81' ' ' VAL . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.677 0.275 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.482 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HD2' HG13 ' A' ' 96' ' ' VAL . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.462 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.735 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.567 ' HG3' HD11 ' A' ' 60' ' ' LEU . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.566 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.551 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.658 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.59 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.1 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.804 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.857 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.864 0.364 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.647 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.755 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.66 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.821 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.66 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.755 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 26' ' ' GLU . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' H ' ' A' ' 25' ' ' ALA . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.488 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.581 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.407 ' CG ' ' HB3' ' A' ' 19' ' ' ASN . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.622 ' HB2' HD21 ' A' ' 42' ' ' LEU . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.436 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.734 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.52 HG12 ' H ' ' A' ' 43' ' ' SER . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 1.071 HG21 HD23 ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' A' ' 61' ' ' ARG . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.417 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.728 0.299 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.071 HD23 HG21 ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 84' ' ' PRO . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.745 0.307 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.854 ' HE3' HG22 ' A' ' 81' ' ' VAL . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.854 HG22 ' HE3' ' A' ' 71' ' ' LYS . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HG2' HG23 ' A' ' 63' ' ' ILE . 85.3 Cg_endo . . . . . 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 . . . . . 0 N--CA 1.458 -0.043 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.56 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.615 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.615 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.526 ' N ' HG13 ' A' ' 96' ' ' VAL . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.647 HD11 ' N ' ' A' ' 5' ' ' GLY . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' HB2' ' A' ' 50' ' ' ALA . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.857 HG21 ' HA ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 18.7 mm-40 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.578 HG23 ' HB3' ' A' ' 25' ' ' ALA . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.822 HD11 HD13 ' A' ' 48' ' ' LEU . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.599 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.454 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.699 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.836 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.836 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.545 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.545 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.699 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.81 HG21 HD11 ' A' ' 107' ' ' ILE . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.677 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.736 ' CD ' HG11 ' A' ' 12' ' ' VAL . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.696 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 40' ' ' VAL . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.761 ' HB2' HD11 ' A' ' 108' ' ' ILE . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 2.8 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HE1' ' SD ' ' A' ' 97' ' ' MET . 3.3 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.73 0.3 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.906 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.413 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.832 0.348 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.51 ' O ' HG22 ' A' ' 80' ' ' VAL . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' HG13 ' A' ' 80' ' ' VAL . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 78' ' ' ASN . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.412 HG13 ' HD2' ' A' ' 82' ' ' PRO . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD2' HG13 ' A' ' 81' ' ' VAL . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo . . . . . 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CD2' HG22 ' A' ' 40' ' ' VAL . 25.4 m-70 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 8' ' ' ILE . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.618 ' HB3' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.403 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.618 HG13 ' HB3' ' A' ' 93' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG23 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.738 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.599 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.733 HD23 ' CD1' ' A' ' 48' ' ' LEU . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.81 HD11 HG21 ' A' ' 18' ' ' ILE . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 48' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.921 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.4 p-80 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.91 0.386 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.434 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.747 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.698 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.853 ' O ' HG12 ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.871 HG11 ' CD ' ' A' ' 36' ' ' LYS . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.698 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.443 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.747 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.625 HG13 HD12 ' A' ' 27' ' ' LEU . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.549 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.457 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.472 ' HG2' HG22 ' A' ' 41' ' ' VAL . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.625 HD12 HG13 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.871 ' CD ' HG11 ' A' ' 12' ' ' VAL . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.878 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 44' ' ' THR . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.485 HG23 ' HB ' ' A' ' 41' ' ' VAL . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.878 HD11 HG13 ' A' ' 40' ' ' VAL . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.43 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.731 HD12 HD13 ' A' ' 62' ' ' LEU . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.573 ' O ' HD13 ' A' ' 60' ' ' LEU . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.332 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.425 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.731 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.495 HG13 ' HG3' ' A' ' 47' ' ' LYS . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.738 0.304 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 81' ' ' VAL . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.813 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 71' ' ' LYS . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.813 ' HD3' HG23 ' A' ' 80' ' ' VAL . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.765 0.317 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.537 ' O ' HD12 ' A' ' 8' ' ' ILE . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.539 ' HD2' HG22 ' A' ' 96' ' ' VAL . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.662 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.662 HG12 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.503 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.603 HG23 HD13 ' A' ' 104' ' ' LEU . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.921 HG21 ' HA ' ' A' ' 3' ' ' HIS . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.603 HD13 HG23 ' A' ' 100' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.534 HD11 HG21 ' A' ' 18' ' ' ILE . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.613 HD11 ' HB2' ' A' ' 48' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.445 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.445 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.817 ' HA ' HG21 ' A' ' 103' ' ' THR . 37.1 p-80 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.829 0.347 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.712 ' HB3' HG13 ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.714 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.88 ' O ' HG12 ' A' ' 12' ' ' VAL . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.88 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.712 HG13 ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.562 HG21 HD11 ' A' ' 107' ' ' ILE . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.588 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.588 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.641 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.564 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.834 ' HD2' HG11 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.685 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 108' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.685 HD11 HG13 ' A' ' 40' ' ' VAL . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.508 HD21 ' CD2' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.782 0.325 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 97' ' ' MET . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.776 0.322 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' CG ' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.945 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.421 HG22 ' CG ' ' A' ' 71' ' ' LYS . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo . . . . . 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.68 0.276 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.58 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.77 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.77 HG12 ' HB3' ' A' ' 93' ' ' ASN . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.512 ' HG3' HD11 ' A' ' 60' ' ' LEU . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.58 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.817 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.564 HD11 ' CD1' ' A' ' 27' ' ' LEU . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.592 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.2 mm-40 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.843 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.4 m80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.892 0.377 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.777 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 13' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.783 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.794 HG21 ' CD ' ' A' ' 36' ' ' LYS . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.734 ' HA ' HD12 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.777 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.778 HG11 ' OE1' ' A' ' 26' ' ' GLU . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.459 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.778 ' OE1' HG11 ' A' ' 22' ' ' VAL . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.613 HD12 HG13 ' A' ' 18' ' ' ILE . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.611 HG21 ' NH1' ' A' ' 30' ' ' ARG . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.414 ' CH2' HG13 ' A' ' 12' ' ' VAL . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.611 ' NH1' HG21 ' A' ' 28' ' ' THR . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.794 ' CD ' HG21 ' A' ' 12' ' ' VAL . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.476 HG22 ' HG2' ' A' ' 26' ' ' GLU . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.445 ' HB3' HG12 ' A' ' 41' ' ' VAL . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.77 HD23 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.411 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.452 ' HA ' HD12 ' A' ' 60' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.836 0.351 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.424 ' HB2' ' HE3' ' A' ' 59' ' ' MET . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.495 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HG3' ' HE3' ' A' ' 88' ' ' MET . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.559 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.475 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.434 ' O ' HG13 ' A' ' 80' ' ' VAL . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' ASN . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.414 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 72.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.541 ' HE3' ' HG3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.436 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.627 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.627 HG12 ' CB ' ' A' ' 93' ' ' ASN . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.461 ' N ' HG13 ' A' ' 96' ' ' VAL . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.597 HD12 ' CG2' ' A' ' 16' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD22 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.843 HG21 ' HA ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.77 ' HB3' HD23 ' A' ' 48' ' ' LEU . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.8 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.449 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.891 ' HA ' HG21 ' A' ' 103' ' ' THR . 13.4 m80 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.865 0.364 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.746 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.683 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.556 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.556 HD13 ' O ' ' A' ' 14' ' ' GLY . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.746 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.509 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.555 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.555 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.753 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.408 ' HD1' HG13 ' A' ' 16' ' ' ILE . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.875 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 107' ' ' ILE . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.875 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.024 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.782 0.325 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.569 ' C ' HD12 ' A' ' 60' ' ' LEU . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.736 HD11 ' HG3' ' A' ' 97' ' ' MET . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.88 0.372 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo . . . . . 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.797 0.332 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.561 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.553 ' CD1' HD13 ' A' ' 60' ' ' LEU . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.805 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' ASN . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.736 ' HG3' HD11 ' A' ' 60' ' ' LEU . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.526 HG23 HD13 ' A' ' 104' ' ' LEU . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' ' 48' ' ' LEU . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.802 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 1.024 HD11 HD13 ' A' ' 48' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.878 ' HA ' HG21 ' A' ' 103' ' ' THR . 6.0 m80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.894 0.378 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.411 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.79 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.79 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.534 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.635 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.464 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.755 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.72 HD12 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' N ' HD22 ' A' ' 48' ' ' LEU . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.724 0.297 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.68 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.471 ' CD2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.82 0.343 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.68 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.886 ' HB3' HG12 ' A' ' 96' ' ' VAL . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.886 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.511 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.602 ' CG2' HD13 ' A' ' 104' ' ' LEU . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.878 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.602 HD13 ' CG2' ' A' ' 100' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 103' ' ' THR . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 48' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 25' ' ' ALA . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.89 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.892 0.377 . . . . 0.0 111.163 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.756 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.438 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.813 ' O ' HG12 ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.813 HG12 ' O ' ' A' ' 9' ' ' PHE . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.564 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.756 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.783 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 26' ' ' GLU . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.429 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.511 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.711 ' HE2' HG11 ' A' ' 12' ' ' VAL . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.811 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.517 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.811 HD11 HG13 ' A' ' 40' ' ' VAL . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.566 ' HB3' HG22 ' A' ' 63' ' ' ILE . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 62' ' ' LEU . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.903 HD13 ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.448 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 46' ' ' ASP . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.502 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.4 ' CD ' ' HG3' ' A' ' 82' ' ' PRO . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' HG13 ' A' ' 80' ' ' VAL . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 78' ' ' ASN . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD3' HG23 ' A' ' 80' ' ' VAL . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.408 ' CB ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HG2' HG23 ' A' ' 63' ' ' ILE . 35.3 Cg_endo . . . . . 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.543 ' CD2' HG22 ' A' ' 40' ' ' VAL . 37.3 m-70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.903 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.539 ' HB3' HG12 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.728 HG13 ' HD2' ' A' ' 91' ' ' PHE . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.465 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.607 HD12 ' CG2' ' A' ' 16' ' ' ILE . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' HD21 ' A' ' 48' ' ' LEU . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.89 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.712 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.406 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.783 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.908 ' HA ' HG21 ' A' ' 103' ' ' THR . 9.2 m80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.916 0.389 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.517 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.768 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.575 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.865 ' O ' HG12 ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.497 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.497 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.768 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.561 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.533 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HG12 ' A' ' 16' ' ' ILE . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.442 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.401 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HE3' HG21 ' A' ' 63' ' ' ILE . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.601 HE22 HD11 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.911 0.386 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.848 HD11 ' HG3' ' A' ' 97' ' ' MET . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.465 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.601 HD11 HE22 ' A' ' 49' ' ' GLN . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.7 0.286 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 80' ' ' VAL . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 78' ' ' ASN . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.716 0.293 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.757 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.804 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.7 t30 -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.804 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.848 ' HG3' HD11 ' A' ' 60' ' ' LEU . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.605 HG23 HD13 ' A' ' 104' ' ' LEU . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.908 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.605 HD13 HG23 ' A' ' 100' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.561 ' CD1' HG21 ' A' ' 18' ' ' ILE . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.954 ' HA ' HG21 ' A' ' 103' ' ' THR . 2.5 p-80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.925 0.393 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.758 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.787 ' O ' HG12 ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.787 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.758 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.585 HG21 HD11 ' A' ' 107' ' ' ILE . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.588 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' HG21 ' A' ' 22' ' ' VAL . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.719 ' CE ' HG11 ' A' ' 12' ' ' VAL . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.73 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 108' ' ' ILE . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.414 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.73 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' HG3' HG13 ' A' ' 63' ' ' ILE . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.6 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.783 0.325 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.509 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.785 0.326 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.405 HG13 ' HD2' ' A' ' 82' ' ' PRO . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.405 ' HD2' HG13 ' A' ' 81' ' ' VAL . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 57.1 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.737 0.303 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.592 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB2' HG12 ' A' ' 96' ' ' VAL . 1.9 m-80 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.704 HG12 ' HB2' ' A' ' 93' ' ' ASN . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.954 HG21 ' HA ' ' A' ' 3' ' ' HIS . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.717 HD11 ' CD1' ' A' ' 27' ' ' LEU . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.575 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.1 mm-40 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 103' ' ' THR . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD11 HD12 ' A' ' 42' ' ' LEU . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.803 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.9 m80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.783 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.892 ' O ' HG12 ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.781 ' HA ' HD12 ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.783 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.562 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.562 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.719 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.852 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG22 ' CD ' ' A' ' 26' ' ' GLU . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.852 HD11 HG13 ' A' ' 40' ' ' VAL . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.87 HD21 ' HA ' ' A' ' 101' ' ' LYS . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.492 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.76 0.314 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.853 0.359 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.477 ' O ' HG13 ' A' ' 80' ' ' VAL . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo . . . . . 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.596 ' CD2' HG22 ' A' ' 40' ' ' VAL . 84.9 m-70 . . . . . 0 C--O 1.23 0.046 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.421 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.595 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.595 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.506 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.572 HG23 HD13 ' A' ' 104' ' ' LEU . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.87 ' HA ' HD21 ' A' ' 48' ' ' LEU . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.803 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.719 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' A' ' 18' ' ' ILE . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 107' ' ' ILE . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.534 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.2 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.744 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.685 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.884 HG11 ' HD3' ' A' ' 36' ' ' LYS . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.685 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.744 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.58 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.719 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.499 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.884 ' HD3' HG11 ' A' ' 12' ' ' VAL . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.867 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.867 HD11 HG13 ' A' ' 40' ' ' VAL . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.076 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' SD ' ' A' ' 97' ' ' MET . 1.4 mtp . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.836 0.35 . . . . 0.0 110.832 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 97' ' ' MET . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HG2' ' HE3' ' A' ' 88' ' ' MET . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.539 HD11 HG21 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 p30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 80' ' ' VAL . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 78' ' ' ASN . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.752 0.31 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.443 ' HE3' ' HG2' ' A' ' 61' ' ' ARG . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 8' ' ' ILE . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.56 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.56 HG12 ' CB ' ' A' ' 93' ' ' ASN . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.496 HG22 HD22 ' A' ' 104' ' ' LEU . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 107' ' ' ILE . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.601 ' CD2' HD21 ' A' ' 48' ' ' LEU . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 108' ' ' ILE . 3.6 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.719 HG23 ' HB3' ' A' ' 25' ' ' ALA . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 1.076 HD11 HD13 ' A' ' 48' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.758 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.753 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.59 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.867 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.867 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.753 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.788 HG21 HD11 ' A' ' 107' ' ' ILE . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.598 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.598 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.739 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.847 ' CD ' HG11 ' A' ' 12' ' ' VAL . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.952 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 104' ' ' LEU . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.43 ' HA ' ' CE1' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.952 HD11 HG13 ' A' ' 40' ' ' VAL . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.451 HD13 ' H ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.797 0.332 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.456 ' C ' HD12 ' A' ' 60' ' ' LEU . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.999 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.586 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.473 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.1 t0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.78 0.324 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.489 ' O ' HG13 ' A' ' 80' ' ' VAL . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.489 HG13 ' O ' ' A' ' 78' ' ' ASN . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 58.6 Cg_endo . . . . . 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.799 0.333 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 8' ' ' ILE . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.999 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 96' ' ' VAL . 1.7 t30 -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.745 HG13 ' HD2' ' A' ' 91' ' ' PHE . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.533 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.794 ' CD1' HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.788 HD11 HG21 ' A' ' 18' ' ' ILE . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.794 HD11 ' CD1' ' A' ' 104' ' ' LEU . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.914 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.854 0.359 . . . . 0.0 111.1 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.73 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.835 ' O ' HG12 ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.492 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.73 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG23 ' A' ' 16' ' ' ILE . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.723 ' CE ' HG11 ' A' ' 12' ' ' VAL . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.731 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.731 HD11 HG13 ' A' ' 40' ' ' VAL . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HG3' ' CG1' ' A' ' 63' ' ' ILE . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.706 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.298 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' A' ' 101' ' ' LYS . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.765 0.317 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 80' ' ' VAL . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.4 ' CG1' ' HD2' ' A' ' 82' ' ' PRO . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' A' ' 81' ' ' VAL . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.765 0.317 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.498 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HD2' HG22 ' A' ' 96' ' ' VAL . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.639 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.639 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.517 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.619 HG23 HD13 ' A' ' 104' ' ' LEU . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.501 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.914 HG21 ' HA ' ' A' ' 3' ' ' HIS . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.706 ' CB ' HD21 ' A' ' 48' ' ' LEU . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.468 ' HA ' ' NE2' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.441 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.705 HD11 ' CD1' ' A' ' 48' ' ' LEU . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.5 ' HA ' HG21 ' A' ' 103' ' ' THR . 15.3 m80 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.825 0.345 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.775 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.668 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.668 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.775 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.785 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.557 HD22 HG13 ' A' ' 22' ' ' VAL . 13.9 t30 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.768 HG21 ' HG3' ' A' ' 26' ' ' GLU . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.469 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.768 ' HG3' HG21 ' A' ' 22' ' ' VAL . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.818 ' HD2' HG11 ' A' ' 12' ' ' VAL . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.512 HG22 ' HG2' ' A' ' 26' ' ' GLU . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.44 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.83 HD12 HD13 ' A' ' 62' ' ' LEU . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.807 0.336 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.521 ' C ' HD12 ' A' ' 60' ' ' LEU . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' C ' ' A' ' 59' ' ' MET . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.83 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.761 0.315 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.806 0.336 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 8' ' ' ILE . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CD2' HG22 ' A' ' 96' ' ' VAL . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.689 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.689 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.497 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.403 ' O ' ' HE2' ' A' ' 102' ' ' MET . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.812 HG23 HD13 ' A' ' 104' ' ' LEU . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.403 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.564 ' CG2' HD13 ' A' ' 18' ' ' ILE . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.812 HD13 HG23 ' A' ' 100' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.785 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 48' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.812 0.255 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 p -99.48 -68.84 0.79 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.892 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -83.36 56.89 3.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -175.8 125.57 0.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.26 150.93 23.12 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.643 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.35 107.15 4.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.974 0.416 . . . . 0.0 110.72 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.716 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.56 151.99 29.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.159 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -95.71 145.17 8.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.833 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.5 t80 -148.82 121.49 8.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.53 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.18 32.7 3.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 mttp 80.95 -5.11 1.71 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.094 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.833 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.9 p -106.4 145.53 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.758 0.313 . . . . 0.0 110.943 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.647 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -94.13 121.5 35.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -123.14 -142.29 6.08 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.267 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.2 mm -134.16 120.73 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.915 0.388 . . . . 0.0 110.971 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.716 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -96.19 121.78 47.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.231 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.73 129.35 30.4 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.282 -178.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.8 mp -85.92 120.22 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -81.23 92.66 6.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.581 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -98.26 26.36 5.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.784 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -107.45 -4.46 18.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.077 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.25 -177.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.924 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.599 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -63.13 -67.66 1.03 Allowed Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.5 Cg_endo -90.38 110.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.405 2.07 . . . . 0.0 110.579 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -45.35 123.42 4.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.916 0.388 . . . . 0.0 111.073 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -110.67 172.3 6.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.373 0.606 . . . . 0.0 111.735 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.872 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -132.25 109.74 10.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.905 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -110.98 121.27 44.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 61.6 t90 -92.19 110.43 21.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 27.3 mtm180 -109.81 114.18 27.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.329 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 92.9 p -46.84 166.24 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 111.214 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -42.17 51.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.431 0.634 . . . . 0.0 109.995 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.79 -33.54 27.26 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.045 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.39 24.49 7.46 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.414 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -102.96 -17.65 15.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 0.0 111.234 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.805 ' HD2' HG11 ' A' ' 12' ' ' VAL . 7.5 mttp -127.82 139.21 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.104 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.72 157.03 16.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.207 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.413 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.5 t60 -156.75 146.58 20.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.765 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.76 137.62 54.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.229 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.2 t -138.99 125.77 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.658 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.538 HG12 ' H ' ' A' ' 43' ' ' SER . 94.0 t -101.22 114.64 41.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.314 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HG13 ' A' ' 45' ' ' ILE . 3.6 mm? -60.58 -21.75 62.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.538 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -59.52 -30.13 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.763 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -92.48 -32.3 14.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.246 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 1.031 HD12 ' HB3' ' A' ' 62' ' ' LEU . 21.8 mm -54.06 102.19 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.838 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -73.67 -33.6 64.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.228 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.837 ' HE2' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -141.16 163.15 33.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.242 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.661 ' CD1' HD23 ' A' ' 104' ' ' LEU . 21.0 tp -120.63 156.07 32.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 61' ' ' ARG . 2.1 mt-30 -140.31 142.11 35.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.045 0.45 . . . . 0.0 111.353 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . -161.54 133.97 5.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.841 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.515 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 32.9 p -86.24 99.42 1.03 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.135 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.515 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.22 163.73 0.22 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.417 2.745 . . . . 0.0 112.288 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.42 -18.72 7.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.426 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -71.24 -20.98 62.17 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.786 0.327 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -93.29 121.15 34.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -59.14 -24.13 62.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.109 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -98.38 115.26 28.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.856 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mmt -91.15 106.12 18.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.906 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 95' ' ' PHE . 48.5 mtm -154.93 139.61 17.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.595 HD13 ' CD1' ' A' ' 91' ' ' PHE . 8.8 mp -114.16 156.47 24.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 49' ' ' GLN . 5.3 mtp180 -152.4 148.97 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.031 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.4 130.72 48.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.817 0.341 . . . . 0.0 111.358 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.837 HG21 ' HE2' ' A' ' 47' ' ' LYS . 49.9 mm -87.46 126.65 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.84 30.19 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.357 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.03 136.67 52.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.862 0.363 . . . . 0.0 110.788 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.679 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.6 p -106.58 -123.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.149 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.679 ' H ' HG13 ' A' ' 66' ' ' VAL . 14.3 t0 -171.41 111.01 0.32 Allowed 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -100.59 30.21 4.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.935 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -117.27 30.18 7.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.906 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.44 -52.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt 61.56 153.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -177.01 -178.94 0.86 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -113.66 -179.75 3.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.42 25.67 7.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.016 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.5 t30 75.96 -0.36 3.17 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.708 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -107.89 -30.98 8.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.124 0.488 . . . . 0.0 110.61 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 123.44 34.06 0.78 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.516 ' O ' HG13 ' A' ' 80' ' ' VAL . 47.1 m-20 -125.38 110.07 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.79 106.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.9 m -122.51 -174.29 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.049 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.1 138.83 25.19 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.038 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.643 ' O ' HG21 ' A' ' 66' ' ' VAL . 53.6 Cg_exo -52.28 127.7 24.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.48 2.12 . . . . 0.0 112.242 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -56.81 124.61 65.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -75.57 130.67 12.9 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.61 2.206 . . . . 0.0 112.519 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.66 115.02 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.526 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.4 ptt85 -120.72 153.52 36.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.257 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.401 ' NE2' HG22 ' A' ' 40' ' ' VAL . 4.8 m-70 -107.61 111.14 23.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.395 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.448 ' HE3' ' CZ ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -89.33 129.52 35.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.934 0.397 . . . . 0.0 111.199 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -127.07 168.91 13.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.59 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.573 ' O ' HD12 ' A' ' 8' ' ' ILE . 9.9 t -136.66 121.0 18.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.924 0.392 . . . . 0.0 111.256 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.595 ' CD1' HD13 ' A' ' 60' ' ' LEU . 5.2 m-85 -101.2 158.26 16.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -126.56 54.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.821 0.343 . . . . 0.0 111.43 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.571 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER 178.5 160.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.837 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -85.5 -36.52 20.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.18 -36.98 39.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.571 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -57.98 -45.42 87.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.202 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.6 ptm -62.9 -34.56 77.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -70.55 -30.53 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.932 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -63.86 -41.22 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.943 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.613 HG23 HD13 ' A' ' 104' ' ' LEU . 30.8 mm -86.26 -48.13 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.233 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -54.94 -38.11 67.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.502 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.9 mtt -83.56 -27.02 29.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.781 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.892 HG21 ' HA ' ' A' ' 3' ' ' HIS . 60.0 m -84.86 -48.43 9.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.515 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.872 HD11 ' CD1' ' A' ' 27' ' ' LEU . 1.8 mp -53.19 -48.79 67.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.869 0.366 . . . . 0.0 110.25 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.584 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.8 OUTLIER -50.89 -29.94 13.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.753 179.28 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.32 -32.96 73.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.263 0.554 . . . . 0.0 110.048 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 42' ' ' LEU . 4.4 mp -84.56 -37.62 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.834 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.584 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.8 mm -49.3 -63.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.624 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 m -61.13 -23.4 65.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.198 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -53.96 -26.04 23.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.265 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -95.88 -37.77 10.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.01 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.47 -49.61 70.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.1 p-10 -56.15 -40.59 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.062 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.87 -48.06 22.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.885 0.374 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -90.24 15.07 11.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.387 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.79 -30.43 19.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 110.909 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -62.2 -31.08 71.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -113.38 23.94 12.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.118 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.489 ' HA ' HG22 ' A' ' 51' ' ' THR . 0.3 OUTLIER -169.1 135.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.833 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.43 161.45 13.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -96.07 162.03 13.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.495 HG12 ' H ' ' B' ' 99' ' ' THR . 2.4 t -135.17 167.19 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.568 HG23 ' O ' ' B' ' 99' ' ' THR . 11.1 t -47.27 107.14 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.25 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -91.92 175.85 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -65.63 -156.62 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.499 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -79.48 154.14 29.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.775 0.321 . . . . 0.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -157.14 -52.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.121 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.488 1.182 0 CA-C-O 120.843 0.268 . . . . 0.0 111.747 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.2 m -100.92 30.86 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.936 ' HA ' HG21 ' A' ' 103' ' ' THR . 5.7 p-80 -176.35 48.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -178.12 129.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.107 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.431 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -149.17 158.5 27.68 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.667 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 105.31 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.67 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.61 154.42 23.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.257 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.664 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -100.3 144.18 12.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.067 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.861 ' O ' HG12 ' A' ' 12' ' ' VAL . 35.6 t80 -148.88 127.92 12.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.414 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.443 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 4.3 mt-10 65.44 30.66 10.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.868 0.366 . . . . 0.0 110.695 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 80.72 -3.72 1.81 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.064 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.861 HG12 ' O ' ' A' ' 9' ' ' PHE . 7.3 p -106.24 148.67 10.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.627 0.251 . . . . 0.0 110.71 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.664 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -97.47 121.88 39.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.029 0.442 . . . . 0.0 111.174 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -125.03 -141.99 5.77 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.937 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -134.49 120.51 33.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.832 0.349 . . . . 0.0 110.915 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 123.24 49.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.06 125.14 18.61 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.992 0.425 . . . . 0.0 111.494 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.634 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -76.82 126.04 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.281 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -87.57 98.0 11.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.634 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -91.57 22.13 4.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.092 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -95.71 -15.05 22.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.242 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG21 ' HG3' ' A' ' 26' ' ' GLU . 27.3 m -92.45 -167.04 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.694 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.445 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -89.59 -62.24 0.21 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.553 -179.563 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 79.8 Cg_endo -79.87 2.48 8.37 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.369 2.046 . . . . 0.0 113.616 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.613 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 60.31 120.6 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.048 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HG3' HG21 ' A' ' 22' ' ' VAL . 33.8 mt-10 -110.9 172.14 7.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.255 -179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.58 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -124.02 110.05 14.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.206 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -104.97 118.72 37.23 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.9 t90 -93.33 110.47 22.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.368 178.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -109.67 114.46 28.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.362 -0.381 . . . . 0.0 109.981 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -47.11 169.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.817 0.342 . . . . 0.0 111.159 -179.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.88 -41.94 58.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.273 0.558 . . . . 0.0 110.163 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -79.31 -31.44 43.19 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.29 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.31 26.45 8.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.422 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -110.05 -18.1 13.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 111.223 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.772 ' CD ' HG11 ' A' ' 12' ' ' VAL . 10.1 mttp -118.29 141.76 48.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 140.64 25.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.165 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 28.9 t60 -150.1 112.95 4.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.626 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.55 146.7 26.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.046 0.451 . . . . 0.0 111.624 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.815 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -136.97 132.07 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.61 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.289 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.3 t -100.48 107.12 20.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.049 -0.66 . . . . 0.0 111.075 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -52.57 -24.73 8.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.164 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.12 -32.56 74.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.108 0.48 . . . . 0.0 110.931 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -91.96 -32.53 15.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.453 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.815 HD11 HG13 ' A' ' 40' ' ' VAL . 21.3 mm -46.22 105.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.249 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.9 -45.42 90.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.077 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -155.37 162.95 40.69 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.996 0.426 . . . . 0.0 111.18 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.93 154.0 22.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.021 179.396 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.434 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -136.54 145.31 44.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.946 0.403 . . . . 0.0 111.393 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.408 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -154.41 132.08 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.917 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.715 HG21 ' O ' ' A' ' 57' ' ' LYS . 3.0 p -56.79 103.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.302 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' A' ' 50' ' ' ALA . 9.6 Cg_endo -48.45 163.75 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.375 2.716 . . . . 0.0 112.316 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.42 -21.74 3.98 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.358 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 p -76.94 -21.47 54.75 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.774 0.321 . . . . 0.0 111.069 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.0 m -94.06 99.89 12.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.51 -23.09 57.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.221 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.715 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.67 117.05 23.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.109 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.428 ' HB3' ' HB2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -73.71 107.69 6.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.102 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 60' ' ' LEU . 32.4 mtm -154.08 139.23 17.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.887 0.375 . . . . 0.0 111.25 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.733 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.4 mp -126.93 140.13 52.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 8.9 mtt180 -114.3 151.73 32.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.843 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.86 111.29 13.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.37 -179.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 43.4 mm -87.47 134.06 28.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.451 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.36 169.58 21.69 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.682 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 138.43 45.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.799 0.333 . . . . 0.0 110.815 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.819 HG21 ' O ' ' A' ' 82' ' ' PRO . 14.5 p -108.95 -124.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.042 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.048 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.668 ' H ' HG13 ' A' ' 66' ' ' VAL . 34.4 t0 -178.14 86.14 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.781 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -98.92 29.4 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -20.53 13.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.165 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -117.08 -39.59 3.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.965 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp 61.44 156.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.868 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -161.53 179.69 8.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -96.12 -176.36 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.938 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -101.88 26.01 7.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.032 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 75.97 0.03 3.24 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.638 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.77 -30.25 9.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.116 0.484 . . . . 0.0 110.679 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.28 32.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.574 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.447 ' O ' HG13 ' A' ' 80' ' ' VAL . 54.1 m-80 -124.72 108.96 12.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.786 0.327 . . . . 0.0 110.856 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.94 88.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.979 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' ASN . 24.0 m -110.54 -174.62 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.066 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 24.0 t -108.32 132.34 21.16 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.881 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.819 ' O ' HG21 ' A' ' 66' ' ' VAL . 37.0 Cg_endo -64.8 125.27 14.5 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.513 2.142 . . . . 0.0 112.414 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.21 136.08 72.7 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.88 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -76.07 150.88 34.22 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.601 2.201 . . . . 0.0 112.524 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -61.05 114.52 3.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.515 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -105.47 114.19 28.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.268 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -93.26 111.27 22.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.386 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.535 ' HE1' ' CZ ' ' B' ' 95' ' ' PHE . 7.3 ttm -87.29 110.12 19.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.235 -179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -113.21 130.67 56.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.478 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.534 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -107.04 121.0 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.18 -179.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.733 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.5 m-85 -94.62 159.35 15.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.55 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -133.42 24.52 4.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.674 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.782 ' HB3' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -157.39 153.1 26.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 0.0 111.021 179.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -78.98 -37.17 40.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.777 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.52 -45.61 61.9 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.326 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.8 p -60.26 -38.28 76.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.174 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.454 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 5.0 ptm -70.61 -35.6 73.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.73 -29.43 66.8 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.739 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -79.11 -54.18 6.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.567 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 19.2 mm -60.03 -51.95 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.201 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -58.41 -37.49 75.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.396 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.8 mmm -83.38 -26.66 30.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.618 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.936 HG21 ' HA ' ' A' ' 3' ' ' HIS . 86.9 m -84.86 -38.6 19.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.171 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.58 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.7 mp -61.1 -55.93 26.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.6 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.0 pt20 -51.96 -28.81 17.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.517 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.4 OUTLIER -61.25 -34.25 74.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.214 0.531 . . . . 0.0 109.913 179.117 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.648 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -82.11 -33.87 11.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.617 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.6 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.0 mm -57.61 -59.09 3.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.328 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.7 m -53.56 -25.9 19.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.25 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 6.2 ttt180 -52.26 -26.1 11.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -99.51 -32.92 10.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.642 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -67.61 0.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.001 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.82 -31.39 68.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.96 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.58 -43.22 69.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.11 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.933 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -90.03 -30.85 17.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.95 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.11 4.13 39.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -58.88 -23.71 61.33 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.633 0.254 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.413 ' HB2' ' CD1' ' B' ' 95' ' ' PHE . 0.7 OUTLIER -108.42 -51.58 2.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.987 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.535 ' CZ ' ' HE1' ' A' ' 88' ' ' MET . 6.0 m-85 -116.84 175.01 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.831 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 152.89 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.967 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.26 162.0 14.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.911 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.531 ' O ' HG13 ' B' ' 98' ' ' VAL . 11.3 p -143.79 116.9 3.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.121 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -147.06 -175.36 4.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.848 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.13 -57.54 2.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 150.87 130.32 1.7 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.532 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -83.71 104.02 13.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.343 . . . . 0.0 110.96 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -105.79 -65.46 1.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.017 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.488 1.195 0 CA-C-O 120.774 0.239 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -106.73 -44.33 4.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.885 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -96.27 39.56 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -166.12 129.09 2.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.977 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.403 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -147.17 153.68 25.5 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.727 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.446 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.32 103.29 2.81 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.019 0.438 . . . . 0.0 110.689 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.75 153.04 24.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.14 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.684 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.23 145.24 12.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.163 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.825 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.2 t80 -145.85 139.98 26.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.41 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 15.4 mt-10 54.12 29.11 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.968 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER 82.01 -3.77 1.51 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.925 179.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.4 p -104.6 141.3 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.849 0.357 . . . . 0.0 110.678 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.684 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.997 0.427 . . . . 0.0 111.03 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.48 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.82 -140.95 4.26 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.292 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.5 mm -137.77 120.71 20.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.868 0.366 . . . . 0.0 110.868 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.35 121.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.9 131.8 31.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.439 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.563 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -84.29 124.61 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.351 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -88.37 92.82 9.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.8 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.06 25.09 5.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.907 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -103.56 -7.59 20.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.058 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -104.17 -176.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.71 -67.38 1.06 Allowed Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.232 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.6 Cg_endo -90.72 109.99 0.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.423 2.082 . . . . 0.0 110.808 178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.664 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.17 118.57 2.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.964 0.411 . . . . 0.0 111.126 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.52 ' OE2' HG22 ' A' ' 41' ' ' VAL . 32.4 mt-10 -110.77 172.06 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.146 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.603 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.91 110.01 14.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.082 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -105.85 115.41 30.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 61.5 t90 -89.8 110.49 21.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.414 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 15' ' ' ILE . 25.3 mtm105 -109.87 116.94 32.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.272 179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.44 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.82 168.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.154 -179.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -40.97 63.67 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.44 0.638 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -91.5 -35.33 14.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.1 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.8 20.41 7.26 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.512 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -90.9 -19.27 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 111.088 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.767 ' HD2' HG11 ' A' ' 12' ' ' VAL . 9.8 mttt -133.81 141.02 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.9 0.381 . . . . 0.0 111.175 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.67 157.46 16.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -157.65 146.8 19.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.9 m -127.51 137.67 52.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.917 0.389 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.714 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -132.87 131.1 59.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.677 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.52 HG22 ' OE2' ' A' ' 26' ' ' GLU . 79.4 t -100.75 107.7 21.7 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.215 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.7 mm? -53.95 -23.52 13.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.421 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p -64.84 -30.3 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.993 0.425 . . . . 0.0 111.045 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -92.85 -33.61 14.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.512 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.714 HD11 HG13 ' A' ' 40' ' ' VAL . 29.1 mm -46.39 109.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.417 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -67.05 -31.61 72.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.6 OUTLIER -172.64 166.87 5.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.451 . . . . 0.0 111.218 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.097 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.91 162.72 13.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.231 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.483 HE22 HD11 ' A' ' 63' ' ' ILE . 3.2 mt-30 -145.55 131.45 19.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.836 0.351 . . . . 0.0 111.032 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB3' ' HD2' ' A' ' 101' ' ' LYS . . . -139.63 141.6 37.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.085 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.494 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 22.3 p -85.76 99.51 0.99 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.494 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.34 163.76 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.417 2.745 . . . . 0.0 112.382 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.77 -19.19 3.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.524 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.21 -20.68 62.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.754 0.311 . . . . 0.0 111.111 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 m -93.13 118.3 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.46 -23.93 63.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.076 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -100.01 115.4 29.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.793 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 mtp -87.08 106.0 17.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.883 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' THR . 5.4 mtm -153.75 139.59 18.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.912 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.585 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 7.9 mp -112.24 141.24 46.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.679 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.463 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.16 151.49 32.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.863 0.363 . . . . 0.0 110.784 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.545 ' CD1' HD12 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -127.95 118.68 24.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.524 -179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.6 mm -87.37 156.78 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.465 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -124.12 -177.68 15.11 Favored Glycine 0 N--CA 1.454 -0.11 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.425 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.19 134.42 36.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.937 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -91.56 -3.89 10.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 122.218 1.008 . . . . 0.0 110.818 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 66' ' ' VAL . 0.4 OUTLIER 81.07 -176.86 0.06 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.443 179.677 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.62 28.62 5.62 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.74 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 24.3 p -86.16 42.45 0.99 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.836 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 69' ' ' SER . 0.0 OUTLIER 74.48 108.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.015 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.808 ' HG3' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -82.54 -169.51 2.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.117 -179.729 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.36 -171.97 2.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -109.74 176.54 5.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.936 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -95.95 23.42 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.035 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 77.45 -3.25 2.46 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.811 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -148.61 87.03 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.058 0.456 . . . . 0.0 111.293 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.88 35.3 0.06 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.512 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -122.38 85.3 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.105 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.14 91.8 1.3 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.36 -176.79 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.318 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.808 HG22 ' HG3' ' A' ' 71' ' ' LYS . 92.1 t -102.0 124.8 38.84 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.338 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.873 ' O ' HG21 ' A' ' 66' ' ' VAL . 8.3 Cg_endo -51.29 145.66 26.59 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.412 2.075 . . . . 0.0 112.141 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -48.31 115.77 4.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.331 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.937 ' HA ' HG23 ' A' ' 66' ' ' VAL . 23.7 Cg_endo -61.12 -166.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.692 2.261 . . . . 0.0 112.098 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.87 172.5 10.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.353 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.88 109.41 2.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.868 0.366 . . . . 0.0 111.444 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 89' ' ' PHE . 92.3 m-70 -105.58 111.1 23.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.404 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 121.55 29.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.921 0.391 . . . . 0.0 111.356 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 87' ' ' HIS . 74.3 m-85 -127.08 130.67 50.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.518 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.508 ' O ' HD12 ' A' ' 8' ' ' ILE . 8.8 t -102.44 112.61 25.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.11 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HD2' HG13 ' A' ' 96' ' ' VAL . 3.5 m-85 -84.38 144.36 28.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -116.8 43.47 2.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.572 ' HB3' HG12 ' A' ' 96' ' ' VAL . 6.1 t-20 -179.04 165.41 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.916 0.388 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.23 -33.46 14.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.41 -25.54 46.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.033 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.621 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.2 p -74.07 -30.33 27.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.82 0.343 . . . . 0.0 111.273 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.46 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 10.6 ptm -75.64 -34.57 60.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.19 0.519 . . . . 0.0 110.729 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -74.76 -26.13 59.56 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.998 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -81.73 -32.31 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.04 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.681 HG22 HD22 ' A' ' 104' ' ' LEU . 15.9 mm -86.18 -51.13 13.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.322 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 6.3 ttpt -58.02 -35.48 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.679 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.5 mtm -83.48 -28.84 28.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 3' ' ' HIS . 84.8 m -84.83 -36.08 21.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.247 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.681 HD22 HG22 ' A' ' 100' ' ' ILE . 3.5 mp -63.89 -57.3 10.22 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.464 ' HA ' HD12 ' A' ' 108' ' ' ILE . 3.5 pt20 -53.96 -25.73 22.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.359 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.4 mm-40 -62.84 -35.07 78.75 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.104 0.478 . . . . 0.0 109.744 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -79.96 -38.11 18.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.471 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 1.097 HD11 HD13 ' A' ' 48' ' ' LEU . 17.5 mt -56.62 -54.44 28.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.378 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.0 m -49.72 -26.44 3.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.368 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.28 -31.5 69.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.774 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -99.74 24.1 8.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.858 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -111.61 -65.94 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -60.73 -32.47 71.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.863 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.74 -37.6 82.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.077 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.887 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.791 0.329 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -89.85 -31.41 17.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.858 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.3 t -68.76 -31.17 70.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.897 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -75.1 -49.18 20.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -75.69 -31.02 59.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.948 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -132.92 135.01 45.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.916 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -100.08 136.45 39.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.931 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -96.03 138.95 32.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.494 HG12 ' N ' ' B' ' 99' ' ' THR . 21.3 t -92.1 161.27 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.832 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.494 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.7 t -46.99 126.31 8.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.268 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.55 -47.13 7.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.931 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 173.89 -131.89 2.15 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -155.15 31.86 0.39 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.839 0.352 . . . . 0.0 110.898 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -141.63 87.56 2.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.918 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.119 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.488 1.167 0 CA-C-O 121.093 0.372 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.93 -51.82 55.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.927 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.924 ' HA ' HG21 ' A' ' 103' ' ' THR . 40.9 p-80 -109.14 42.67 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.921 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.7 p -178.41 128.79 0.12 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.24 161.85 28.85 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.738 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.2 4.69 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.984 0.421 . . . . 0.0 110.738 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.75 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.87 165.34 12.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.308 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.3 mt -119.64 141.4 39.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.165 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -142.14 117.11 9.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.902 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 72.31 36.02 1.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.124 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm 77.3 -1.23 2.78 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.185 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.8 p -106.93 136.82 40.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.342 . . . . 0.0 110.731 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.1 p -83.94 147.97 27.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.939 0.399 . . . . 0.0 110.905 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -156.6 -151.37 5.94 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.181 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.6 mm -130.68 120.53 48.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.938 0.399 . . . . 0.0 110.982 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.75 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -98.31 121.49 48.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.01 130.98 26.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.042 0.448 . . . . 0.0 111.466 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.497 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -79.64 128.7 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.485 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.48 92.78 8.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.711 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -95.5 25.4 4.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.926 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.07 -7.49 20.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.94 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 m -104.83 -176.34 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.881 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.75 -67.5 1.03 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.245 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 47.0 Cg_endo -90.53 110.22 0.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 122.419 2.079 . . . . 0.0 110.826 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.656 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.5 118.86 2.7 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.015 0.436 . . . . 0.0 111.087 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HG2' HG22 ' A' ' 41' ' ' VAL . 25.7 mt-10 -110.81 172.03 7.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.083 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.633 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -120.92 109.96 15.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.54 113.63 27.28 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.449 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 52.1 t90 -93.22 110.57 22.09 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.268 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' ILE . 79.3 mtm-85 -109.77 114.86 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 65.5 m -46.8 167.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.803 0.335 . . . . 0.0 111.253 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.6 -39.64 77.14 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.543 0.687 . . . . 0.0 109.406 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -93.22 -37.65 11.96 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.1 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.25 16.62 8.82 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.356 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.87 -18.72 50.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.695 0.283 . . . . 0.0 110.993 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HD3' HG11 ' A' ' 12' ' ' VAL . 10.7 mtpt -140.41 145.9 37.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.954 0.407 . . . . 0.0 111.328 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.85 149.28 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.029 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.5 t60 -146.86 146.76 30.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.669 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.9 m -135.55 106.36 6.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.769 0.318 . . . . 0.0 111.522 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.625 HG13 HD11 ' A' ' 45' ' ' ILE . 2.9 t -98.16 135.3 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.6 t -100.65 105.53 17.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 120.286 -0.565 . . . . 0.0 111.137 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.8 mm? -54.66 -24.54 22.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.143 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 6.7 p -65.01 -28.8 69.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 110.975 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -93.19 -31.61 14.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.374 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.625 HD11 HG13 ' A' ' 40' ' ' VAL . 37.2 mm -48.1 99.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.281 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -74.37 -28.35 61.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.027 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.643 ' CE ' HG21 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -149.04 145.99 27.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.877 0.37 . . . . 0.0 111.188 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.552 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -109.01 153.07 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.143 179.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.447 ' HA ' HG23 ' B' ' 98' ' ' VAL . 0.1 OUTLIER -138.23 140.46 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 111.266 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.63 131.32 4.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.084 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.508 HG23 ' O ' ' A' ' 59' ' ' MET . 57.6 p -62.51 148.49 90.35 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.378 0.608 . . . . 0.0 110.962 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -85.04 164.33 11.53 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.83 3.02 . . . . 0.0 112.328 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.19 -6.2 8.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.168 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.6 m -90.37 -21.43 21.99 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.794 0.331 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.5 t -96.39 117.6 31.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.883 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -21.25 58.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.104 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.67 118.5 23.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.897 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -98.73 106.06 18.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.797 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.508 ' O ' HG23 ' A' ' 51' ' ' THR . 19.4 mtm -152.75 139.36 18.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.121 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.0 mp -117.52 165.7 13.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' B' ' 95' ' ' PHE . 15.0 mtp180 -148.97 153.67 38.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.882 0.373 . . . . 0.0 111.286 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -127.88 117.15 21.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.643 HG21 ' CE ' ' A' ' 47' ' ' LYS . 39.2 mm -87.21 117.04 30.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.856 0.36 . . . . 0.0 111.041 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.53 153.96 32.27 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.286 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.86 138.13 58.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.767 0.318 . . . . 0.0 110.738 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.672 HG13 ' H ' ' A' ' 67' ' ' ASP . 11.6 p -104.09 -122.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.249 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.672 ' H ' HG13 ' A' ' 66' ' ' VAL . 6.6 m-20 -161.18 122.69 2.93 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.848 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -104.13 32.36 4.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 70.8 m -145.65 36.38 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.955 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -130.78 -62.82 0.89 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.65 114.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.936 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -140.5 -178.31 5.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.945 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.9 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -100.6 25.57 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.065 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 71.74 0.34 3.47 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.963 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -103.4 -29.46 11.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 110.696 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.78 26.19 2.88 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.536 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -126.17 119.58 27.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.767 0.318 . . . . 0.0 110.822 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -59.21 124.46 20.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -143.6 -173.94 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.415 HG13 ' HD2' ' A' ' 82' ' ' PRO . 24.4 t -110.16 137.06 20.46 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.024 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.663 ' O ' HG21 ' A' ' 66' ' ' VAL . 10.3 Cg_endo -51.54 129.7 30.5 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.576 2.184 . . . . 0.0 112.273 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 127.64 91.53 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.882 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.31 139.49 23.55 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.684 2.256 . . . . 0.0 112.377 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 114.98 2.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.508 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -117.61 147.49 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.959 0.409 . . . . 0.0 111.532 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.528 ' CD2' HG22 ' A' ' 40' ' ' VAL . 22.6 m-70 -117.08 116.04 26.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.288 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.15 110.21 19.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 111.48 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 16' ' ' ILE . 83.0 m-85 -104.48 143.84 32.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.34 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -115.46 111.0 20.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.847 0.356 . . . . 0.0 111.091 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.545 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.0 m-85 -87.91 163.36 16.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.529 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -139.97 31.42 2.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.691 0.281 . . . . 0.0 111.596 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.759 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.5 t-20 -163.01 156.02 19.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.805 0.336 . . . . 0.0 110.962 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -80.88 -40.79 24.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.825 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -42.33 73.92 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.272 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.759 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.7 p -61.99 -40.18 86.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.086 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.447 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 17.5 ptm -70.58 -35.52 73.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.267 0.556 . . . . 0.0 110.379 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.41 ' N ' ' HG3' ' A' ' 97' ' ' MET . 3.4 m-20 -70.28 -29.43 66.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 -53.75 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.497 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.5 mm -61.61 -49.62 83.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.172 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -38.93 81.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.332 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.4 mtm -83.52 -25.48 31.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.489 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.8 m -84.83 -34.65 22.64 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.169 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.633 HD11 ' CD1' ' A' ' 27' ' ' LEU . 2.8 mp -62.67 -59.37 5.01 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.585 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 4.1 pt20 -51.82 -27.25 11.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.405 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.38 -35.46 79.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.927 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.826 HD12 ' O ' ' A' ' 103' ' ' THR . 2.9 mp -81.38 -36.22 14.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.744 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.585 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.2 mm -54.02 -57.75 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.8 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.8 t -49.38 -26.64 3.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.673 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.0 mtp-105 -59.6 -29.02 67.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.841 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 5.1 m-85 -95.12 -29.46 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.928 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.51 -57.01 14.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.65 -31.38 69.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.9 -40.37 47.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.2 t0 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.926 -179.977 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.874 0.369 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -74.45 -31.46 62.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 78.2 p -66.02 -28.8 69.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.013 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -58.45 -39.88 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.989 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -100.98 -34.48 9.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.865 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.439 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -99.34 139.01 35.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.843 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -94.05 163.18 13.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.994 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -96.06 162.0 13.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 48' ' ' LEU . 4.0 t -135.2 164.45 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.836 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.511 HG23 ' O ' ' B' ' 99' ' ' THR . 11.7 t -46.95 112.16 0.48 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.31 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -134.55 -48.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 164.58 -29.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.515 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.8 t30 61.02 157.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.797 0.332 . . . . 0.0 110.913 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -168.56 -46.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.881 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.133 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.162 0 CA-C-O 120.841 0.267 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 p -75.77 -31.59 59.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.928 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.826 ' HA ' HG21 ' A' ' 103' ' ' THR . 14.5 m80 -98.24 38.49 1.32 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 178.84 132.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.046 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.48 154.9 26.14 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.541 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.48 4.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.955 0.407 . . . . 0.0 110.674 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.43 152.6 29.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.249 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -99.59 145.19 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.044 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.864 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -148.39 126.96 12.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.493 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 65.59 31.4 10.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.743 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm 80.52 -3.94 1.84 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.068 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.8 p -106.39 144.4 15.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.736 0.303 . . . . 0.0 110.904 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 39.7 p -93.1 131.54 38.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.058 0.456 . . . . 0.0 110.991 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.58 -139.6 4.04 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.362 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.0 mm -137.57 120.55 20.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.794 0.331 . . . . 0.0 110.859 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.729 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.48 122.24 48.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.03 132.8 30.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.379 -178.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.55 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.5 mp -84.56 125.28 40.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.536 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.21 92.91 9.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.757 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -95.4 24.86 4.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -102.66 -8.41 20.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.887 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 23.0 m -103.67 -175.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.887 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.561 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.58 -66.41 1.39 Allowed Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.279 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.561 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.6 Cg_endo -90.92 109.74 0.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.352 2.035 . . . . 0.0 110.829 178.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.36 118.21 2.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.967 0.413 . . . . 0.0 111.121 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.451 ' HG2' HG22 ' A' ' 41' ' ' VAL . 17.0 mt-10 -110.77 172.03 7.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.089 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.658 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.2 tt -123.27 109.99 14.64 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.8 m -103.34 114.86 29.47 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 60.8 t90 -89.58 110.53 21.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.408 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -109.37 114.74 28.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.245 179.388 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.467 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 2.8 p -47.07 164.64 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.2 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -41.0 62.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.45 0.643 . . . . 0.0 109.886 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.21 -36.64 27.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.236 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.74 26.3 5.89 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.348 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -105.75 -18.48 14.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.663 0.268 . . . . 0.0 111.347 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.66 140.28 52.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.872 0.367 . . . . 0.0 111.045 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 152.67 16.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.347 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.453 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 2.3 t60 -155.92 146.78 22.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 132.05 45.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 111.469 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -125.15 133.31 69.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.622 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.4 t -100.74 103.82 15.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.219 -0.592 . . . . 0.0 111.146 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 108' ' ' ILE . 3.6 mm? -50.99 -26.23 5.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 23.9 m -64.28 -30.74 71.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.981 0.42 . . . . 0.0 110.727 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -92.86 -33.46 14.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.242 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.891 HD11 HG13 ' A' ' 40' ' ' VAL . 24.9 mm -46.54 102.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.199 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -55.23 -34.44 63.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.179 -179.832 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 18.3 pttt -174.0 170.47 3.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.106 0.479 . . . . 0.0 111.322 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.67 13.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.15 179.597 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.43 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 46.5 mt-30 -146.76 132.6 19.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.961 0.41 . . . . 0.0 111.208 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.33 132.55 29.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.852 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.518 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -51.28 101.79 0.28 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.43 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.518 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -47.46 163.91 0.16 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.439 2.759 . . . . 0.0 112.171 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -49.43 -22.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.482 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -73.48 -21.53 60.4 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.761 0.315 . . . . 0.0 111.136 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.408 ' HB2' ' HB ' ' A' ' 51' ' ' THR . 20.0 m -97.34 115.17 27.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.843 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -77.43 -16.94 58.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.499 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' CE ' ' H ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 123.27 29.71 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 120.754 0.311 . . . . 0.0 111.168 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.37 106.08 5.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.669 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG3' HG23 ' A' ' 51' ' ' THR . 0.4 OUTLIER -159.94 139.38 11.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.879 0.371 . . . . 0.0 111.21 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD11 ' HG3' ' A' ' 97' ' ' MET . 4.8 mp -125.06 143.8 50.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.785 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.26 153.79 29.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.988 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.85 115.76 19.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.11 -179.495 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 51.2 mm -87.33 132.03 33.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.619 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.27 163.79 20.12 Favored Glycine 0 CA--C 1.517 0.177 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.566 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -56.42 143.95 32.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.835 0.35 . . . . 0.0 110.95 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.8 p -105.75 -123.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.094 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.675 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.5 p30 -172.25 120.01 0.42 Allowed 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.93 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -102.63 31.46 4.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.817 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.9 p -97.04 -21.19 17.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.193 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -149.15 87.78 1.55 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.893 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -63.56 170.65 3.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -160.15 168.82 24.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -108.34 174.31 5.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.997 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -101.72 26.47 7.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.041 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 75.93 -0.06 3.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -105.74 -31.09 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.079 0.466 . . . . 0.0 110.637 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.68 -8.51 5.24 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.656 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -88.59 109.16 19.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.857 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.4 pm0 -65.8 78.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.6 m -84.4 -174.45 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.076 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.451 HG12 HG21 ' A' ' 66' ' ' VAL . 33.9 t -104.69 136.98 19.1 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.911 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD2' HG13 ' A' ' 81' ' ' VAL . 7.7 Cg_endo -50.16 138.01 37.04 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.655 2.237 . . . . 0.0 112.338 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.19 109.52 1.65 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.095 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.76 142.27 47.47 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.589 2.193 . . . . 0.0 112.438 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -61.99 116.29 4.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.2 ptt-85 -125.91 160.7 29.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.214 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -114.39 151.22 33.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.659 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.1 ttt -110.72 110.27 20.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -111.0 130.64 55.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.573 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.482 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -107.29 114.86 29.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HD2' HG13 ' A' ' 96' ' ' VAL . 4.2 m-85 -83.23 145.49 29.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.677 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -106.53 26.0 10.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.46 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.462 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.3 t30 -172.36 156.1 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 111.007 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -38.4 33.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.92 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.6 80.85 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.833 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.735 HG13 ' HD2' ' A' ' 91' ' ' PHE . 14.9 p -59.33 -27.0 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.08 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.567 ' HG3' HD11 ' A' ' 60' ' ' LEU . 4.7 ttp -71.36 -40.47 70.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.111 0.481 . . . . 0.0 110.806 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -68.79 -26.63 65.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.017 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -76.25 -35.77 58.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.161 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.566 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.7 mm -86.26 -51.14 13.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.327 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.551 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -57.83 -37.24 73.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.715 -179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.4 mtp -83.39 -27.32 29.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.831 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 3' ' ' HIS . 47.4 m -84.83 -37.45 20.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.225 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.658 HD11 ' CD1' ' A' ' 27' ' ' LEU . 3.6 mp -62.1 -56.8 15.2 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.59 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.1 pt20 -52.25 -28.05 17.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.544 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -34.65 76.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.222 0.534 . . . . 0.0 109.859 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.804 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.36 -36.04 14.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.674 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 36.1 mm -55.04 -58.99 2.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.856 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -49.43 -26.22 3.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.835 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -58.32 -28.66 65.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.961 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 4.1 m-85 -95.77 -46.78 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.1 mtmm -60.24 -58.68 7.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.39 -31.29 69.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.68 -34.5 58.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.833 -179.938 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.825 0.345 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -74.16 -48.43 29.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.1 -31.24 23.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -59.9 -31.38 69.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.994 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.05 -31.57 72.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.04 135.04 33.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.816 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -114.31 152.64 31.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -86.08 161.96 18.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.99 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.615 HG13 ' OE1' ' B' ' 103' ' ' GLU . 11.6 t -136.01 107.05 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.161 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.02 134.02 20.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.859 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 64.64 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -168.73 -150.55 6.72 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.456 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 60.4 86.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 110.92 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . 0.615 ' OE1' HG13 ' B' ' 98' ' ' VAL . 2.0 tp10 -125.79 84.91 2.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.893 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.118 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.167 0.403 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.74 -56.76 4.25 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.941 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.857 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.4 m80 -97.75 38.81 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 p 179.29 132.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.073 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.647 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -146.01 153.25 25.19 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.563 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.37 105.0 3.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.07 0.462 . . . . 0.0 110.73 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.755 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.8 153.24 26.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.102 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.66 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -96.81 145.35 9.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.225 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.821 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.9 t80 -149.48 122.68 8.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.477 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 68.84 31.79 4.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.757 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mttp 81.18 -5.49 1.64 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.6 p -105.96 144.01 16.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.757 0.313 . . . . 0.0 110.875 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.66 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -92.66 118.35 30.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.062 0.458 . . . . 0.0 111.117 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -120.45 -143.6 6.87 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.122 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.7 mm -132.88 120.58 41.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.911 0.386 . . . . 0.0 110.946 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.755 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.47 122.73 47.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.52 132.05 30.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.008 0.433 . . . . 0.0 111.604 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.1 mp -88.0 117.14 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.142 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HB3' ' CG ' ' A' ' 26' ' ' GLU . 1.6 t30 -83.23 102.87 12.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -91.11 15.73 11.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.223 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.65 -17.63 33.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.954 0.407 . . . . 0.0 110.234 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' H ' ' A' ' 25' ' ' ALA . 26.3 m -84.52 -164.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.463 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.488 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -96.17 -55.05 0.21 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 121.243 -0.183 . . . . 0.0 111.295 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.0 Cg_endo -88.09 9.0 3.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.936 2.424 . . . . 0.0 112.891 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.581 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 58.23 121.67 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.909 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.407 ' CG ' ' HB3' ' A' ' 19' ' ' ASN . 15.1 pt-20 -111.01 172.04 7.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.335 0.588 . . . . 0.0 111.831 -179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.622 ' HB2' HD21 ' A' ' 42' ' ' LEU . 2.3 tt -126.86 110.06 12.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.043 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.3 m -110.23 122.33 47.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.431 ' CH2' ' HG3' ' A' ' 36' ' ' LYS . 67.3 t90 -93.19 110.51 22.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.544 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -109.1 113.1 25.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.163 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.436 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 3.3 p -47.07 167.69 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.816 0.341 . . . . 0.0 111.225 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -40.95 64.73 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 109.79 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.0 -46.31 18.47 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.001 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.03 24.76 5.62 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.296 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -97.91 -19.35 18.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.712 0.292 . . . . 0.0 111.151 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.734 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -136.42 145.92 45.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.18 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.38 16.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.128 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CD2' ' CE2' ' A' ' 9' ' ' PHE . 6.8 t60 -143.81 146.56 33.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.755 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -121.16 137.25 54.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.287 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 t -138.81 127.44 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.625 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.731 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.52 HG12 ' H ' ' A' ' 43' ' ' SER . 96.8 t -101.12 112.61 34.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.336 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -58.15 -21.92 48.97 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.991 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.52 ' H ' HG12 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -59.22 -39.47 82.83 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.113 0.482 . . . . 0.0 110.762 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -80.99 -32.66 34.2 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.209 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 1.071 HG21 HD23 ' A' ' 62' ' ' LEU . 18.5 mm -56.61 102.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.845 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -74.25 -24.92 59.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.275 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -150.93 158.95 44.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.093 0.473 . . . . 0.0 111.404 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -117.79 155.81 29.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.4 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HA ' HG23 ' B' ' 98' ' ' VAL . 4.7 tt0 -135.14 149.55 50.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.39 . . . . 0.0 111.304 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.417 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . -161.49 132.8 5.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.062 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.572 HG23 ' O ' ' A' ' 59' ' ' MET . 20.4 p -85.88 99.59 1.04 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.58 163.74 0.17 Allowed 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.425 2.75 . . . . 0.0 112.292 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.3 -17.2 7.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.512 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.1 m -71.24 -21.39 62.12 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.781 0.324 . . . . 0.0 111.222 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -88.4 124.16 33.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.899 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -60.67 -29.3 69.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.979 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.07 121.68 43.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.838 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.0 mtp -90.42 105.91 18.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.092 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.572 ' O ' HG23 ' A' ' 51' ' ' THR . 10.6 mtm -145.98 139.15 25.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.793 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.928 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 9.6 mp -110.92 165.75 11.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 49' ' ' GLN . 42.7 mtm180 -156.28 144.45 19.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.071 HD23 HG21 ' A' ' 45' ' ' ILE . 0.9 OUTLIER -128.08 123.89 35.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.367 . . . . 0.0 111.163 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.507 HD12 HH11 ' A' ' 86' ' ' ARG . 43.6 mm -87.49 128.55 39.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.76 175.12 54.16 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.52 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.72 137.97 37.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 110.757 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.841 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.8 p -112.78 -126.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.074 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.687 ' N ' HG13 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -179.87 106.57 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.707 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -98.37 29.0 3.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.988 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.6 31.86 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.935 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 mmpm? -138.49 -62.07 0.57 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.96 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.854 ' HE3' HG22 ' A' ' 81' ' ' VAL . 0.4 OUTLIER 63.62 138.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -170.04 3.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -96.23 -168.72 1.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.867 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -108.52 22.26 16.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.206 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.9 -0.2 3.43 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.919 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -122.11 -47.18 2.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.21 0.528 . . . . 0.0 110.761 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 150.75 43.01 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.529 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -125.4 179.18 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 110.708 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -122.15 109.09 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.945 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.1 m -132.0 -175.38 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.854 HG22 ' HE3' ' A' ' 71' ' ' LYS . 36.9 t -122.96 138.54 29.85 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.803 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.841 ' O ' HG21 ' A' ' 66' ' ' VAL . 76.7 Cg_exo -50.18 124.55 13.08 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.425 2.083 . . . . 0.0 112.327 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 140.45 26.29 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.035 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HG2' HG23 ' A' ' 63' ' ' ILE . 85.3 Cg_endo -79.29 178.92 6.89 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.728 2.285 . . . . 0.0 112.594 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -78.4 165.61 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.339 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.507 HH11 HD12 ' A' ' 63' ' ' ILE . 33.4 mtt-85 -151.79 109.32 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 0.0 111.501 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.6 111.09 22.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.081 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.21 112.79 22.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.906 0.384 . . . . 0.0 111.564 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -115.69 130.67 56.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.409 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.56 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -101.37 116.47 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.978 0.418 . . . . 0.0 111.262 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.928 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.2 m-85 -93.41 156.17 16.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -134.18 20.14 3.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.615 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -147.03 145.44 29.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.8 0.333 . . . . 0.0 110.921 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -78.03 -35.93 49.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -45.92 49.02 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.574 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.615 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -56.46 -48.96 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.144 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.526 ' N ' HG13 ' A' ' 96' ' ' VAL . 3.8 ppp? -61.81 -32.44 72.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.269 0.557 . . . . 0.0 110.281 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.78 -42.98 94.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.345 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 10.5 p30 -81.76 -35.75 29.29 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.24 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.647 HD11 ' N ' ' A' ' 5' ' ' GLY . 8.4 mm -65.14 -54.37 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.873 0.368 . . . . 0.0 110.665 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' HB2' ' A' ' 50' ' ' ALA . 11.8 ttpp -63.09 -31.92 73.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.974 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.4 mtp -83.4 -25.42 31.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.39 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.857 HG21 ' HA ' ' A' ' 3' ' ' HIS . 35.1 m -84.88 -47.6 10.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.062 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.47 ' O ' HG12 ' A' ' 108' ' ' ILE . 7.2 mp -54.57 -47.88 72.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.753 0.311 . . . . 0.0 110.267 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.583 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -52.67 -29.1 24.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.771 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 18.7 mm-40 -61.49 -35.09 76.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.21 0.529 . . . . 0.0 109.889 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.578 HG23 ' HB3' ' A' ' 25' ' ' ALA . 3.8 mp -79.14 -36.28 18.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.623 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.822 HD11 HD13 ' A' ' 48' ' ' LEU . 33.5 mm -54.97 -61.08 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.963 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 m -50.4 -24.84 3.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.097 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -57.3 -41.86 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.8 0.333 . . . . 0.0 111.107 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -77.42 -27.13 52.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.889 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.7 -66.83 0.38 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -58.69 -31.44 68.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.98 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.64 -62.74 1.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.169 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.886 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.855 0.36 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.49 -39.66 37.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 58.7 m -60.17 -34.46 73.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.88 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -31.16 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.37 -62.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.465 ' CE1' ' HE3' ' A' ' 59' ' ' MET . 1.6 m-85 -83.15 158.21 22.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.734 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.97 148.69 21.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.08 162.08 13.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.502 HG12 ' N ' ' B' ' 99' ' ' THR . 9.7 t -126.52 163.98 27.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.847 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.502 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.4 t -46.85 138.9 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.898 0.38 . . . . 0.0 111.252 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.94 -172.38 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.865 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -95.07 -62.28 1.01 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.482 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -160.3 -176.83 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.862 0.363 . . . . 0.0 110.9 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . 0.636 ' HG3' HG12 ' B' ' 104' ' ' VAL . 15.4 pt-20 -131.95 -46.57 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.935 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.636 HG12 ' HG3' ' B' ' 103' ' ' GLU . 10.0 p . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.12 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 N--CA 1.489 1.21 0 CA-C-O 120.881 0.284 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m -84.45 2.92 38.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.409 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.599 ' HA ' HG21 ' A' ' 103' ' ' THR . 17.6 m80 60.78 38.45 18.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.839 0.352 . . . . 0.0 110.919 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.5 p 178.9 136.16 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.312 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.454 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.52 155.26 26.31 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 104.47 3.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.073 0.463 . . . . 0.0 110.778 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.699 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -108.65 162.71 13.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.182 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -114.3 144.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.309 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.836 ' O ' HG12 ' A' ' 12' ' ' VAL . 59.5 t80 -145.9 138.83 25.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.48 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 3.6 mm-40 54.68 28.32 9.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.747 0.308 . . . . 0.0 110.953 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 4.9 mttm 82.12 -2.99 1.49 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.843 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.836 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -104.41 136.53 37.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.859 0.362 . . . . 0.0 110.656 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 p -87.92 131.76 34.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.979 0.419 . . . . 0.0 111.092 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.545 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -135.9 -138.66 3.87 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.072 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.545 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.7 mm -138.86 120.69 16.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.845 0.355 . . . . 0.0 110.779 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.699 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.93 122.74 48.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.74 132.41 27.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.006 0.431 . . . . 0.0 111.331 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.81 HG21 HD11 ' A' ' 107' ' ' ILE . 4.6 mp -82.81 130.08 36.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.4 t30 -95.86 92.82 6.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.653 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -95.62 25.27 4.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.958 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -104.38 -7.05 20.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.944 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.3 m -104.16 -176.19 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.836 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.26 -67.23 1.08 Allowed Pre-proline 0 C--N 1.33 -0.274 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.4 Cg_endo -90.61 109.73 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 0.0 110.921 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.11 115.18 1.2 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.895 0.379 . . . . 0.0 111.117 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -110.88 167.5 10.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.098 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.677 ' CD1' HD11 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -116.81 109.81 17.59 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.003 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -101.35 117.11 34.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.4 t90 -93.69 110.4 22.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.18 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.5 mtt85 -110.06 117.13 32.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.067 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 20.6 p -46.71 166.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.222 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -40.77 66.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.48 0.657 . . . . 0.0 109.687 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.24 -34.43 17.75 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.006 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.57 24.28 6.5 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.479 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -99.96 -17.9 17.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.683 0.277 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.736 ' CD ' HG11 ' A' ' 12' ' ' VAL . 2.8 mtpt -128.97 140.77 51.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.955 0.407 . . . . 0.0 111.106 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.66 149.37 18.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.944 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.7 t60 -158.97 116.64 2.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.911 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.1 m -104.65 146.79 28.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.004 0.43 . . . . 0.0 111.501 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.696 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -133.1 136.96 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.673 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.84 106.67 19.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.152 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -55.7 -22.85 25.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.329 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 16.5 m -64.75 -28.38 69.54 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.982 0.42 . . . . 0.0 111.058 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -96.33 -32.65 12.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.279 0.561 . . . . 0.0 110.497 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 40' ' ' VAL . 23.1 mm -45.69 106.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.371 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -65.54 -41.35 93.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.249 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -154.54 156.65 37.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.904 0.383 . . . . 0.0 111.322 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.761 ' HB2' HD11 ' A' ' 108' ' ' ILE . 2.6 tp -110.22 153.66 24.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.967 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.485 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 2.8 mt-30 -135.31 149.96 49.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.152 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.53 132.56 5.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.098 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 59' ' ' MET . 35.1 p -84.78 99.6 0.88 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.12 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.474 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.9 Cg_endo -47.41 163.75 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 123.486 2.791 . . . . 0.0 112.328 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.76 -17.73 6.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.519 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -71.17 -21.15 62.21 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -90.97 123.6 34.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.871 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.21 -24.58 63.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.114 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -99.69 135.34 41.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.84 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HE1' ' SD ' ' A' ' 97' ' ' MET . 3.3 mtp -105.74 105.94 16.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.899 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.86 ' O ' HG23 ' A' ' 51' ' ' THR . 2.3 mpp? -156.51 139.47 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.981 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.906 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 8.3 mp -116.42 140.83 48.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.659 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 22.8 mtt180 -114.29 149.69 35.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.953 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.413 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.88 109.82 11.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.08 -179.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.673 HD13 ' HB3' ' A' ' 86' ' ' ARG . 47.8 mm -87.33 135.67 24.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.7 167.18 23.05 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.556 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.09 143.51 48.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.842 0.353 . . . . 0.0 110.834 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.718 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.6 p -111.28 -126.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.027 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG13 ' A' ' 66' ' ' VAL . 0.8 OUTLIER -142.47 -175.88 4.63 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.918 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -177.12 37.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.7 t -125.43 43.61 3.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.91 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt 65.56 82.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -101.59 -168.38 1.54 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.003 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.72 161.99 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.95 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.51 ' O ' HG22 ' A' ' 80' ' ' VAL . 2.5 mmmm -96.4 -167.64 1.6 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.735 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -109.35 20.42 18.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.9 t30 71.91 -0.29 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.962 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -125.58 -46.37 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.336 0.589 . . . . 0.0 110.72 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.09 41.95 0.02 OUTLIER Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.448 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' HG13 ' A' ' 80' ' ' VAL . 3.9 m-80 -134.48 107.53 7.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.0 110.703 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -62.11 82.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.044 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 78' ' ' ASN . 9.7 m -81.93 -173.51 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.967 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.618 ' CG1' HG22 ' A' ' 66' ' ' VAL . 35.1 t -133.56 137.25 28.47 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.706 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD2' HG13 ' A' ' 81' ' ' VAL . 2.7 Cg_endo -46.26 124.22 7.45 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.695 2.263 . . . . 0.0 112.202 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.79 129.82 1.89 Allowed Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.338 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -68.02 130.15 20.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.608 2.205 . . . . 0.0 112.592 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -63.11 114.72 3.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.437 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.673 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -117.22 161.93 18.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.293 -179.493 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CD2' HG22 ' A' ' 40' ' ' VAL . 25.4 m-70 -115.51 124.76 51.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.6 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.8 ttm -87.26 110.12 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.036 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 87' ' ' HIS . 52.2 m-85 -112.5 132.54 55.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.69 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 8' ' ' ILE . 2.2 t -108.74 126.83 53.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.474 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.3 m-85 -96.74 143.78 27.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.106 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -113.55 -21.85 10.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.411 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.618 ' HB3' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -99.03 156.01 17.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.854 -179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.403 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . 2.8 ptm85 -92.16 -33.32 14.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.015 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.84 -31.05 28.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.618 HG13 ' HB3' ' A' ' 93' ' ' ASN . 15.9 m -64.31 -46.93 91.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.071 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.495 ' N ' HG23 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -60.42 -31.08 70.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 0.0 110.373 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -62.93 -41.01 99.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.233 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 12.5 p30 -81.8 -33.22 30.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.759 0.314 . . . . 0.0 111.276 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.738 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 26.1 mm -69.89 -57.54 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.194 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HD3' HG21 ' B' ' 98' ' ' VAL . 0.6 OUTLIER -53.06 -35.57 59.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.559 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.1 ptm -83.67 -39.37 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 111.806 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.599 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.1 m -74.13 -35.43 64.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.624 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.733 HD23 ' CD1' ' A' ' 48' ' ' LEU . 4.4 mp -64.13 -60.14 3.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' ILE . 11.0 pt20 -54.01 -25.63 22.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.285 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -63.5 -35.76 81.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.277 0.56 . . . . 0.0 109.76 179.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.81 HD11 HG21 ' A' ' 18' ' ' ILE . 5.6 mt -80.16 -36.19 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.558 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 48' ' ' LEU . 17.1 mt -58.83 -59.08 4.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.471 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.4 m -53.5 -24.74 14.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.202 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.407 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -56.91 -49.41 75.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.536 179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -73.15 -25.87 60.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.704 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -63.82 1.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.111 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.52 -30.92 67.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -65.42 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.149 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.857 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -88.8 -44.84 10.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.921 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.21 -28.62 68.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.058 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -31.88 66.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.034 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -59.77 4.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.856 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.409 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -79.06 134.97 36.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.76 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.9 165.16 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.016 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -96.08 162.05 13.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 48' ' ' LEU . 10.7 p -127.79 130.54 70.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.132 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.06 99.12 3.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.33 150.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.911 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -142.53 -159.73 8.06 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -131.27 139.29 49.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -136.46 119.71 16.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.169 179.991 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 N--CA 1.488 1.186 0 CA-C-O 120.827 0.261 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -109.28 -28.3 9.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.921 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.4 p-80 -151.71 49.67 0.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.791 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.4 p -178.48 128.63 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.842 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.434 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -148.03 156.45 26.92 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.707 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.5 4.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.912 0.386 . . . . 0.0 110.79 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.747 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -113.98 149.95 34.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.195 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.698 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -98.32 145.2 10.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.153 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.853 ' O ' HG12 ' A' ' 12' ' ' VAL . 27.2 t80 -148.91 128.47 13.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.429 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 3.7 mt-10 64.88 30.83 11.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.831 0.348 . . . . 0.0 110.671 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mttt 80.68 -4.24 1.79 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.014 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.871 HG11 ' CD ' ' A' ' 36' ' ' LYS . 11.0 p -105.83 142.37 19.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.802 0.334 . . . . 0.0 110.902 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.698 ' HA ' HG13 ' A' ' 8' ' ' ILE . 35.3 p -92.45 127.64 38.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.087 0.47 . . . . 0.0 111.042 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.443 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.69 -141.9 4.86 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.287 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.5 mm -135.34 120.48 28.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.933 0.397 . . . . 0.0 110.99 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.747 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.69 123.34 47.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.4 129.52 25.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 111.682 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.625 HG13 HD12 ' A' ' 27' ' ' LEU . 3.9 mp -83.77 120.53 34.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -83.57 96.06 8.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.508 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -88.98 15.82 7.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.371 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -87.73 -15.71 36.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.961 0.41 . . . . 0.0 110.522 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.549 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.4 m -90.43 -164.95 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.655 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.457 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.63 -62.26 0.18 Allowed Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 71.6 Cg_endo -80.12 3.71 7.4 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.427 2.084 . . . . 0.0 113.571 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 61.47 131.75 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.08 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.472 ' HG2' HG22 ' A' ' 41' ' ' VAL . 38.7 mt-10 -122.22 172.12 8.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.176 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.625 HD12 HG13 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -128.88 110.1 11.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.341 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.4 m -107.35 116.14 31.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.5 t90 -89.58 110.48 21.34 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.265 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.3 ttt-85 -110.36 116.9 32.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.472 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 0.5 OUTLIER -46.97 168.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.947 0.403 . . . . 0.0 111.161 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -41.12 62.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 109.717 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.41 -33.69 15.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.071 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.7 19.45 8.7 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -89.72 -18.96 25.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.695 0.283 . . . . 0.0 111.025 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.871 ' CD ' HG11 ' A' ' 12' ' ' VAL . 8.0 mttm -135.23 140.74 45.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.66 157.5 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.106 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -157.4 146.78 20.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.57 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -126.09 132.78 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.915 0.388 . . . . 0.0 111.298 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.878 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -128.11 130.36 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.612 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.562 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 44' ' ' THR . 91.8 t -100.51 106.65 19.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.983 179.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 27' ' ' LEU . 3.9 mm? -51.31 -25.25 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.249 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -66.72 -32.85 74.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.054 0.454 . . . . 0.0 110.799 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.485 HG23 ' HB ' ' A' ' 41' ' ' VAL . 2.2 p -88.23 -34.52 17.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.072 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.878 HD11 HG13 ' A' ' 40' ' ' VAL . 20.7 mm -45.18 98.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.086 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.43 ' CB ' HG22 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -52.54 -31.36 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.448 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HG3' HG13 ' A' ' 63' ' ' ILE . 4.4 pttt -175.86 159.48 2.23 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.098 0.475 . . . . 0.0 111.327 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.731 HD12 HD13 ' A' ' 62' ' ' LEU . 3.8 tp -108.86 152.95 24.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.063 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.811 ' HA ' HG23 ' B' ' 98' ' ' VAL . 28.8 mt-30 -151.36 131.42 13.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.567 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . . . -138.63 152.32 48.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.887 0.375 . . . . 0.0 111.296 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' CE2' ' B' ' 95' ' ' PHE . 47.6 p -86.94 99.41 1.13 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.7 Cg_endo -48.75 163.69 0.27 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.471 2.78 . . . . 0.0 112.3 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.51 -17.82 15.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.404 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.2 m -71.36 -21.16 62.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -95.48 121.89 37.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.83 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.94 -22.84 50.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.198 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.17 116.99 29.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.4 mtp -96.22 106.2 18.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.405 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 1.8 mpp? -152.94 139.85 19.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.06 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -101.43 144.74 29.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.803 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.425 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 6.4 mtt180 -127.52 140.58 52.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.001 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.731 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -128.09 114.47 17.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.201 -179.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 86' ' ' ARG . 41.9 mm -87.09 128.53 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.349 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.11 164.79 22.61 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.729 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -56.42 148.66 18.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.838 0.351 . . . . 0.0 110.859 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.751 HG13 ' H ' ' A' ' 67' ' ' ASP . 7.1 p -97.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.753 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.751 ' H ' HG13 ' A' ' 66' ' ' VAL . 4.7 t0 76.77 -179.3 0.14 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.347 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -98.24 28.73 3.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.979 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.2 m -112.66 29.89 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -146.68 -66.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 81' ' ' VAL . 19.8 mttt 60.4 162.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.43 -177.11 0.81 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -94.26 159.55 15.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -97.38 26.78 4.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 76.25 -0.8 3.04 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.667 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -109.94 -32.85 6.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 131.62 -5.97 5.53 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.813 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -89.41 136.14 33.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.935 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -77.91 114.0 16.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.813 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.6 m -155.4 -172.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.988 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 71' ' ' LYS . 22.0 t -130.3 71.02 82.41 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.213 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.813 ' HD3' HG23 ' A' ' 80' ' ' VAL . 23.8 Cg_exo -63.71 -59.61 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.621 2.214 . . . . 0.0 112.034 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.16 155.18 77.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.06 146.45 87.26 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.669 2.246 . . . . 0.0 112.481 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -60.15 121.87 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.566 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.598 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -127.05 159.14 35.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.217 -179.639 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 -111.66 120.74 43.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.551 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -88.66 110.18 20.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.197 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -107.57 148.17 29.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.48 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.537 ' O ' HD12 ' A' ' 8' ' ' ILE . 11.1 t -128.07 124.42 36.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.836 0.35 . . . . 0.0 111.243 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.539 ' HD2' HG22 ' A' ' 96' ' ' VAL . 6.2 m-85 -104.49 173.53 6.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -129.73 35.06 4.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.634 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.662 ' CB ' HG12 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -172.95 154.96 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 179.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -37.15 58.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.61 -46.99 43.71 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.662 HG12 ' CB ' ' A' ' 93' ' ' ASN . 11.4 p -57.8 -46.1 87.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.948 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.503 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.7 ppp? -67.5 -35.02 78.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.217 0.532 . . . . 0.0 110.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.27 -29.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.641 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -64.5 -34.81 79.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.603 HG23 HD13 ' A' ' 104' ' ' LEU . 29.4 mm -86.3 -46.58 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 2.6 ttmt -59.91 -36.09 76.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.185 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.3 mtt -83.49 -27.38 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.921 HG21 ' HA ' ' A' ' 3' ' ' HIS . 50.7 m -84.82 -46.07 11.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.312 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.603 HD13 HG23 ' A' ' 100' ' ' ILE . 6.4 mp -54.41 -49.67 69.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -51.03 -29.52 12.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.704 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -60.92 -35.62 77.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.288 0.566 . . . . 0.0 109.964 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.534 HD11 HG21 ' A' ' 18' ' ' ILE . 3.2 mp -82.44 -36.04 13.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.755 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.613 HD11 ' HB2' ' A' ' 48' ' ' LEU . 8.0 mt -58.25 -57.87 8.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.425 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -26.35 42.05 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.165 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.445 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -53.54 -48.36 69.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.55 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.445 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.8 m-85 -72.62 -28.64 62.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.274 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -68.13 0.24 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.109 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.42 -30.74 68.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.963 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.09 -59.46 3.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.935 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' B' ' 91' ' ' ASP . 50.3 p90 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.779 0.324 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . 0.43 ' HB2' ' CE1' ' B' ' 90' ' ' TYR . 9.1 t0 -89.89 -69.6 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 95.2 p -110.26 -31.85 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.952 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -60.83 -29.12 69.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.982 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -84.04 -30.05 26.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.946 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.562 ' CE2' HG23 ' A' ' 51' ' ' THR . 1.2 t80 -167.53 135.0 2.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.97 131.54 54.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.99 145.93 25.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.811 HG23 ' HA ' ' A' ' 49' ' ' GLN . 2.6 t -96.27 166.12 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.732 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.484 ' H ' HG12 ' B' ' 98' ' ' VAL . 13.2 t -47.0 161.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.869 0.366 . . . . 0.0 111.265 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -127.79 -48.02 1.38 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 155.64 68.29 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.43 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -115.56 109.51 17.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -109.31 34.38 3.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.937 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.613 ' O ' HG13 ' B' ' 104' ' ' VAL . 7.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.489 1.211 0 CA-C-O 120.948 0.312 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.8 p -114.85 -48.2 2.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.893 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.817 ' HA ' HG21 ' A' ' 103' ' ' THR . 37.1 p-80 -115.51 40.39 2.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.889 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 p 179.64 126.4 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.091 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -140.53 -155.62 6.59 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.805 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -109.77 108.15 18.39 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.803 0.335 . . . . 0.0 110.537 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.712 ' HB3' HG13 ' A' ' 16' ' ' ILE . . . -116.66 152.96 33.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.395 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.714 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.2 mm -99.29 145.28 10.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.838 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.88 ' O ' HG12 ' A' ' 12' ' ' VAL . 4.4 t80 -139.05 112.06 7.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.057 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.1 mt-10 69.78 34.5 2.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.131 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 1.5 mttt 83.6 -7.63 1.1 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.95 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.88 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.5 p -103.31 128.29 56.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.005 0.431 . . . . 0.0 110.641 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -71.45 158.35 36.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.635 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 31' ' ' SER . . . -166.51 -151.19 6.69 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.311 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.3 mm -132.23 120.71 44.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.88 0.371 . . . . 0.0 110.862 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.712 HG13 ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.72 122.16 49.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.119 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.37 129.99 25.87 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.678 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.562 HG21 HD11 ' A' ' 107' ' ' ILE . 5.1 mp -80.35 128.29 38.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.351 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 92.82 7.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.67 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -96.45 25.76 4.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.853 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.78 -7.14 19.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.913 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.12 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.893 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.588 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.96 -67.41 1.05 Allowed Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.588 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -90.03 109.57 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.418 2.078 . . . . 0.0 110.95 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.641 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.58 116.84 1.75 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.995 0.426 . . . . 0.0 111.126 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -110.76 172.04 7.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.002 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.564 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.1 tt -122.08 109.79 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -100.23 114.84 28.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -91.61 110.53 21.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.18 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' O ' ' N ' ' A' ' 15' ' ' ILE . 9.4 ttt180 -112.45 114.44 27.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.2 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 2.1 t -46.83 168.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.191 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -41.35 61.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 109.751 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -84.1 -36.84 22.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.023 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.05 24.13 6.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.435 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -99.97 -18.73 16.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.687 0.28 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.834 ' HD2' HG11 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -128.38 138.61 52.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.94 0.4 . . . . 0.0 111.107 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -143.59 147.83 19.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.843 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 73.9 t60 -158.27 119.61 3.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.806 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.8 m -105.06 143.55 33.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.409 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.685 HG13 HD11 ' A' ' 45' ' ' ILE . 2.8 t -128.9 135.69 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.629 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.7 t -100.64 105.29 17.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.06 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 108' ' ' ILE . 3.8 mm? -54.65 -23.12 15.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.246 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.3 p -62.28 -31.98 72.65 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.008 0.432 . . . . 0.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -93.45 -33.49 13.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.294 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.685 HD11 HG13 ' A' ' 40' ' ' VAL . 22.8 mm -45.77 100.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.251 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.412 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.4 t0 -58.08 -32.73 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.273 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' HG3' HG13 ' A' ' 63' ' ' ILE . 14.0 pttt -172.59 168.29 5.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.508 HD21 ' CD2' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -109.02 162.61 14.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.139 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -141.05 138.47 33.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.082 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.405 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -148.42 131.99 16.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.144 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 57' ' ' LYS . 1.0 OUTLIER -59.81 103.71 0.39 Allowed Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.29 163.68 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.435 2.756 . . . . 0.0 112.275 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.61 -19.13 9.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.361 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -21.39 50.46 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.5 m -90.17 114.66 26.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.984 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.6 -23.22 66.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.116 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.571 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -90.72 127.9 36.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.3 mtp -94.15 105.92 17.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HE3' ' CE1' ' B' ' 95' ' ' PHE . 23.3 mtm -153.34 139.41 18.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.913 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.512 HD11 ' HG3' ' A' ' 97' ' ' MET . 7.9 mp -117.01 138.37 51.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.945 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -114.4 153.75 29.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.623 179.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -122.66 114.5 20.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.522 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.13 131.34 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.364 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -111.37 175.36 17.54 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.698 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -85.76 141.57 29.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 0.0 110.878 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.982 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -77.85 -8.64 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.34 0 CA-C-O 121.996 0.903 . . . . 0.0 111.296 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 60.69 -175.06 0.12 Allowed 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.755 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.61 -20.76 12.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.17 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 m -103.12 -20.03 14.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -16.0 39.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' CG ' HG22 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -45.02 107.49 0.1 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.843 0.354 . . . . 0.0 111.342 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -165.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mmtt -115.87 -174.49 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.901 0.382 . . . . 0.0 111.161 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.419 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 5.2 t0 -108.2 52.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.138 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.419 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.81 -51.94 0.25 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.078 0.466 . . . . 0.0 112.029 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -87.4 -46.52 9.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.018 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.05 19.82 0.04 OUTLIER Glycine 0 C--N 1.316 -0.563 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -87.97 112.33 22.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.705 0.288 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -58.51 131.04 49.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.683 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.945 HG23 ' HD3' ' A' ' 82' ' ' PRO . 27.5 m -155.03 -170.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.941 0.4 . . . . 0.0 111.444 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.472 HG13 HG11 ' A' ' 66' ' ' VAL . 38.1 t -143.28 74.33 17.46 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.802 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 80' ' ' VAL . 59.4 Cg_endo -72.66 -48.92 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.821 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 138.29 15.88 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.362 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.982 ' HA ' HG23 ' A' ' 66' ' ' VAL . 88.8 Cg_endo -81.81 140.95 11.81 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.923 2.416 . . . . 0.0 112.322 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.81 115.52 3.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.464 ' CB ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -131.3 162.47 29.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.925 0.393 . . . . 0.0 111.456 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -116.69 151.25 36.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.522 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.86 110.16 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.135 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 80.1 m-85 -112.01 138.82 48.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.517 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.77 135.75 50.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.185 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.58 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 4.7 m-85 -112.32 134.56 53.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.73 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -100.49 -21.03 15.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.348 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.77 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.4 t-20 -113.49 145.6 40.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.001 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.33 30.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.918 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -51.34 65.61 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.248 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.77 HG12 ' HB3' ' A' ' 93' ' ' ASN . 11.6 p -56.39 -39.18 59.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.512 ' HG3' HD11 ' A' ' 60' ' ' LEU . 9.2 ttp -64.68 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.522 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.51 -38.53 87.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.923 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -81.72 -33.13 31.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.965 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.58 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 6.5 mm -73.98 -53.57 17.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.054 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.84 -42.22 83.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.364 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -71.41 -38.84 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.423 . . . . 0.0 111.437 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.817 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.9 m -74.74 -37.94 62.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.174 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.564 HD11 ' CD1' ' A' ' 27' ' ' LEU . 4.0 mp -62.67 -58.15 8.52 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.592 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 2.9 pt20 -52.9 -26.82 16.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.506 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.2 mm-40 -63.07 -34.85 78.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.856 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 103' ' ' THR . 2.7 mp -81.52 -36.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.715 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 105' ' ' GLN . 39.2 mm -52.65 -63.1 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.547 179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -24.38 61.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.204 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -49.98 -27.37 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.136 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 7.9 m-85 -97.18 -29.61 13.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.812 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -70.9 -59.8 2.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -57.96 -31.2 66.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.9 64.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.92 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.736 0.303 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -89.95 -31.3 17.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.934 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 48.2 t -96.45 -31.17 12.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -60.12 -31.5 70.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.901 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -88.41 -62.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.47 ' CE1' ' HE3' ' A' ' 59' ' ' MET . 5.4 m-85 -78.77 135.03 36.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.708 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.83 154.87 18.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -90.31 162.02 15.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.0 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.574 ' O ' HG13 ' B' ' 98' ' ' VAL . 10.2 p -139.23 111.2 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.475 HG22 ' H ' ' B' ' 100' ' ' ASP . 0.2 OUTLIER -147.03 -177.52 5.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.861 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.475 ' H ' HG22 ' B' ' 99' ' ' THR . 2.1 m-20 -154.93 77.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.93 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.63 103.41 2.54 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.61 172.58 11.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.786 0.327 . . . . 0.0 110.924 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.11 84.69 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.113 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.199 0 CA-C-O 120.946 0.311 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 t -95.39 -43.38 8.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.843 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.4 m80 -105.64 38.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.935 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.1 p 179.03 130.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.63 158.59 27.73 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.706 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 106.19 3.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.993 0.425 . . . . 0.0 110.621 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.777 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.06 150.14 36.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.471 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 13' ' ' SER . 2.3 mm -103.26 145.41 12.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.412 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.783 ' O ' HG12 ' A' ' 12' ' ' VAL . 31.7 t80 -137.57 105.93 5.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.71 0.291 . . . . 0.0 111.213 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER 71.74 38.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.316 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 83.69 -11.55 0.88 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.794 HG21 ' CD ' ' A' ' 36' ' ' LYS . 8.1 p -98.51 123.83 51.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 121.106 0.479 . . . . 0.0 110.75 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.734 ' HA ' HD12 ' A' ' 8' ' ' ILE . 51.3 p -75.52 154.73 36.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.949 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -165.94 -146.44 4.82 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.141 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -137.15 120.61 21.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.93 0.395 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.777 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -95.79 123.65 48.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.027 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.99 131.21 24.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.969 0.414 . . . . 0.0 111.652 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.0 mp -90.17 117.21 33.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.208 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -83.04 100.48 10.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.64 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -91.96 20.23 5.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.225 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.32 -14.99 24.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.013 0.435 . . . . 0.0 110.193 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.778 HG11 ' OE1' ' A' ' 26' ' ' GLU . 27.8 m -88.36 -166.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.558 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.459 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -94.61 -53.65 0.24 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.816 -0.174 . . . . 0.0 111.197 -179.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.494 ' O ' ' O ' ' A' ' 25' ' ' ALA . 4.1 Cg_endo -86.98 10.28 3.65 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.951 2.434 . . . . 0.0 113.308 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 47.54 111.24 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.465 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.778 ' OE1' HG11 ' A' ' 22' ' ' VAL . 5.1 mp0 -110.55 161.58 15.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.083 0.468 . . . . 0.0 111.232 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.613 HD12 HG13 ' A' ' 18' ' ' ILE . 4.1 tt -116.68 110.28 18.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.271 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.611 HG21 ' NH1' ' A' ' 30' ' ' ARG . 24.6 m -102.48 117.46 34.76 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.414 ' CH2' HG13 ' A' ' 12' ' ' VAL . 60.4 t90 -89.4 110.2 21.03 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.692 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.611 ' NH1' HG21 ' A' ' 28' ' ' THR . 24.2 mtt-85 -107.08 113.33 26.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.356 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.0 t -46.7 162.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.896 0.379 . . . . 0.0 111.195 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -72.61 -40.83 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 121.453 0.644 . . . . 0.0 109.641 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -79.98 -36.97 35.26 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.65 25.13 7.42 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.476 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 -17.43 14.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.614 0.245 . . . . 0.0 111.188 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.794 ' CD ' HG21 ' A' ' 12' ' ' VAL . 14.0 mtpt -128.29 144.5 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.69 157.47 16.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.169 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 2.3 t60 -156.0 146.98 22.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.587 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -130.28 138.12 50.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.963 0.411 . . . . 0.0 111.575 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.5 t -130.53 134.4 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.512 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.476 HG22 ' HG2' ' A' ' 26' ' ' GLU . 96.5 t -100.72 101.66 12.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.285 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.55 -25.33 16.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.422 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.445 ' HB3' HG12 ' A' ' 41' ' ' VAL . 11.5 t -61.45 -28.4 69.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.954 0.406 . . . . 0.0 110.865 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -99.18 -32.2 11.35 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.408 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 31.2 mm -46.76 100.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.176 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -59.43 -31.97 69.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.16 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 63' ' ' ILE . 0.9 OUTLIER 178.17 155.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.88 0.371 . . . . 0.0 110.93 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.77 HD23 ' HB3' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -108.95 161.23 15.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.444 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.411 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -131.16 131.1 43.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.817 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.452 ' HA ' HD12 ' A' ' 60' ' ' LEU . . . -129.02 132.47 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.198 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.51 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 41.3 p -88.1 99.27 1.29 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.059 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.3 Cg_endo -48.47 163.73 0.25 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 123.4 2.733 . . . . 0.0 112.37 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.87 -15.73 14.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.428 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -71.2 -21.43 62.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.749 0.309 . . . . 0.0 111.174 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 m -92.92 125.67 37.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.836 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.98 -25.61 63.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.022 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -100.01 115.15 29.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.9 mtp -95.27 106.06 18.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.78 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.447 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 15.5 mtm -153.24 139.58 18.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.949 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.495 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -105.38 140.63 38.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HG3' ' HE3' ' A' ' 88' ' ' MET . 3.5 mtt-85 -120.41 150.96 39.95 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.903 0.382 . . . . 0.0 111.138 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.559 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.36 118.92 24.04 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.375 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 46.7 mm -87.24 156.79 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.437 179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.475 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.91 172.27 16.44 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.452 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -77.87 137.26 38.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.75 0.309 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.782 HG21 ' O ' ' A' ' 82' ' ' PRO . 12.0 p -105.0 -123.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.106 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.68 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.8 m-20 -177.44 119.95 0.11 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.82 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -100.99 30.8 3.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.858 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.5 p -84.89 -19.84 31.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.268 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -47.97 3.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.639 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt 60.72 115.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.943 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -127.65 172.76 10.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -100.46 -169.85 1.78 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.793 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -132.18 25.41 4.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.69 -0.07 3.28 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.719 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -104.87 -29.73 10.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.097 0.475 . . . . 0.0 110.685 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.37 25.92 3.33 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.529 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.434 ' O ' HG13 ' A' ' 80' ' ' VAL . 21.2 m-80 -123.13 118.49 27.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.732 0.301 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.47 82.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 78' ' ' ASN . 23.0 m -82.94 -174.24 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.035 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.2 t -115.34 138.7 23.81 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.97 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.782 ' O ' HG21 ' A' ' 66' ' ' VAL . 54.3 Cg_exo -51.94 131.06 37.12 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.44 2.093 . . . . 0.0 112.311 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.58 122.4 44.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.002 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.414 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 72.1 Cg_endo -74.88 -176.31 2.78 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.587 2.192 . . . . 0.0 112.495 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -80.04 115.36 19.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -106.62 116.36 31.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.508 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -93.15 111.7 23.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.541 ' HE3' ' HG3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -87.16 110.1 19.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.977 0.417 . . . . 0.0 111.682 -179.162 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -106.79 166.52 10.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.864 178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.436 ' O ' HG12 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -136.18 135.31 39.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.889 0.376 . . . . 0.0 111.147 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 6.3 m-85 -118.87 164.34 15.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.52 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -111.0 -25.36 9.84 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.627 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -115.57 162.95 16.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.908 0.385 . . . . 0.0 111.126 -179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -86.58 -39.53 16.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.055 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -39.53 69.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.641 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.627 HG12 ' CB ' ' A' ' 93' ' ' ASN . 8.3 p -62.31 -44.12 98.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.871 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.461 ' N ' HG13 ' A' ' 96' ' ' VAL . 5.0 ptm -64.94 -35.7 82.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.223 0.535 . . . . 0.0 110.442 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.84 -28.09 68.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.623 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -66.99 -30.55 70.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.683 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.597 HD12 ' CG2' ' A' ' 16' ' ' ILE . 29.2 mm -84.18 -51.31 14.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.988 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD22 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -55.49 -34.55 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.476 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ptm -83.69 -39.34 20.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.992 0.425 . . . . 0.0 111.511 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.843 HG21 ' HA ' ' A' ' 3' ' ' HIS . 58.3 m -73.0 -44.36 61.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 -179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.77 ' HB3' HD23 ' A' ' 48' ' ' LEU . 8.1 mp -59.87 -56.1 25.95 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.0 pt20 -51.93 -29.92 22.31 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.477 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -63.69 -32.71 74.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.292 0.568 . . . . 0.0 109.657 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.8 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.9 mt -83.86 -33.86 9.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.605 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -60.67 -54.67 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.248 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -52.23 -25.68 9.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.13 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.449 ' HG2' ' CD1' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -57.34 -48.47 78.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.437 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' A' ' 110' ' ' ARG . 3.0 m-85 -72.09 -26.12 62.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -55.7 -67.01 0.32 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.142 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -31.31 69.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.926 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.58 -43.02 77.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.085 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.872 -179.97 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.852 0.358 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . 0.407 ' HB2' ' CE2' ' B' ' 95' ' ' PHE . 1.6 p30 -60.02 -31.57 70.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -34.72 76.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.902 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.23 28.79 8.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.95 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -119.99 -41.87 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.904 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.447 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 1.6 m-85 -94.49 144.19 25.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.778 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -93.94 149.6 21.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.925 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -96.1 150.07 20.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.174 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.641 ' HB ' HD12 ' A' ' 48' ' ' LEU . 34.3 t -99.99 163.96 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.537 ' N ' HG12 ' B' ' 98' ' ' VAL . 14.5 t -46.67 146.17 1.64 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.844 0.355 . . . . 0.0 111.39 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -151.71 -174.01 4.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.9 170.98 44.49 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.57 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -141.67 76.06 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.68 147.02 46.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.303 -0.856 . . . . 0.0 111.121 179.975 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.192 0 CA-C-O 120.887 0.286 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -95.93 -30.67 13.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.892 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.891 ' HA ' HG21 ' A' ' 103' ' ' THR . 13.4 m80 -97.38 38.84 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 p 179.12 134.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.1 156.91 27.04 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.49 106.87 4.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.972 0.415 . . . . 0.0 110.702 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.746 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.15 150.76 35.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.234 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.8 mp -101.23 141.38 17.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.146 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -106.95 105.29 15.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 71.02 -59.22 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.07 0.462 . . . . 0.0 111.351 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -160.02 -12.33 0.05 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.41 127.12 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.242 0 CA-C-O 120.775 0.321 . . . . 0.0 110.516 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.683 ' HA ' HG13 ' A' ' 8' ' ' ILE . 8.1 p -82.2 141.38 33.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.085 0.469 . . . . 0.0 111.364 -179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.556 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -148.49 -137.03 2.79 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.088 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.556 HD13 ' O ' ' A' ' 14' ' ' GLY . 4.6 mm -140.35 120.74 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.93 0.395 . . . . 0.0 111.024 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.746 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.82 123.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.91 133.64 28.83 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.057 0.456 . . . . 0.0 111.561 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.509 ' H ' HD12 ' A' ' 18' ' ' ILE . 4.6 mp -86.58 123.59 39.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.249 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.85 94.55 9.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.879 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -96.36 24.51 5.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.913 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -103.07 -8.04 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.4 m -104.59 -176.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.795 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.555 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.99 -65.63 1.53 Allowed Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.555 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 52.9 Cg_endo -89.9 109.14 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.29 1.994 . . . . 0.0 110.991 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -51.81 115.45 1.67 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.916 0.389 . . . . 0.0 111.145 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -110.99 166.68 10.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.753 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.6 tt -116.65 110.06 18.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.5 m -102.73 122.31 44.2 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.408 ' HD1' HG13 ' A' ' 16' ' ' ILE . 57.2 t90 -95.15 110.5 22.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.461 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 99.4 mtt180 -109.76 112.91 25.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.154 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 18.7 m -46.87 164.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.869 0.366 . . . . 0.0 111.158 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -40.07 71.83 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.542 0.687 . . . . 0.0 109.492 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.42 -43.42 15.88 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.052 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.84 21.4 6.76 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.328 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -91.36 -18.07 24.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.574 0.226 . . . . 0.0 111.156 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 147.19 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 111.231 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 152.67 16.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.107 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -148.02 146.82 29.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.746 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.44 132.24 45.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.93 0.395 . . . . 0.0 111.264 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.875 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -127.0 132.56 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.539 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.887 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.5 t -101.13 104.19 15.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.965 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 107' ' ' ILE . 3.8 mm? -51.22 -24.56 4.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.391 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.9 m -64.66 -29.96 70.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.922 0.391 . . . . 0.0 111.015 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.11 -32.49 13.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.427 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.875 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.75 108.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.26 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.71 -50.26 74.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.987 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -155.15 167.4 30.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.038 0.446 . . . . 0.0 111.098 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.024 HD13 HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -108.95 162.45 14.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.069 179.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -143.39 142.04 31.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.93 0.395 . . . . 0.0 111.325 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.8 131.45 13.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.043 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.6 HG23 ' O ' ' A' ' 59' ' ' MET . 53.4 p -54.24 102.79 0.33 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.307 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -47.6 163.76 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.417 2.745 . . . . 0.0 112.334 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.92 -17.6 6.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.516 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -71.2 -21.09 62.19 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.747 0.308 . . . . 0.0 111.13 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.32 130.17 54.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.797 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.36 -19.82 52.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.85 117.75 23.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.082 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.99 111.95 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.769 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.6 ' O ' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -153.24 139.59 18.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.06 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.736 HD11 ' HG3' ' A' ' 97' ' ' MET . 9.5 mp -126.8 139.65 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.957 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.41 153.77 29.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.469 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.604 HD11 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.94 115.72 18.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.64 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 28.6 mm -91.75 134.9 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.407 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.95 170.62 21.92 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.48 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 141.02 49.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.763 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.756 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.2 p -106.51 -123.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.149 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.68 ' H ' HG13 ' A' ' 66' ' ' VAL . 1.7 p30 -176.32 132.46 0.23 Allowed 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -100.16 29.76 4.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.5 p -110.34 -21.17 12.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.206 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt -76.37 -71.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.946 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 mmtt 60.79 79.45 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.87 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -106.07 -173.73 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.938 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.76 177.49 4.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -96.57 20.84 10.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.119 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.1 t30 75.35 -2.82 2.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.107 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -146.72 87.58 1.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.974 0.416 . . . . 0.0 111.425 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 34.63 35.18 0.05 OUTLIER Glycine 0 CA--C 1.52 0.395 0 CA-C-N 115.415 -0.812 . . . . 0.0 113.567 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -128.13 135.17 49.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 0.0 110.957 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -103.04 110.76 22.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.8 m -129.53 -174.03 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.121 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.35 138.89 22.62 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.08 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.756 ' O ' HG21 ' A' ' 66' ' ' VAL . 54.3 Cg_exo -51.96 130.23 33.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.46 2.107 . . . . 0.0 112.316 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.64 136.41 70.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -75.68 -168.47 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.571 2.181 . . . . 0.0 112.517 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -86.31 115.62 23.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.644 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -100.48 110.18 22.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -93.27 113.38 25.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.547 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.59 126.27 35.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.152 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.561 ' CD1' HD11 ' A' ' 16' ' ' ILE . 98.1 m-85 -126.74 131.1 51.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.53 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.549 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -107.52 111.1 23.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.146 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.553 ' CD1' HD13 ' A' ' 60' ' ' LEU . 3.9 m-85 -84.13 -176.46 6.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.31 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -151.42 35.2 0.57 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.805 ' HB3' HG12 ' A' ' 96' ' ' VAL . 3.2 t30 -175.98 161.18 2.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.379 . . . . 0.0 111.154 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -79.47 -41.31 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.511 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.5 -45.5 75.63 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.888 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' ASN . 8.4 p -61.94 -36.54 74.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.736 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.736 ' HG3' HD11 ' A' ' 60' ' ' LEU . 41.0 ttp -70.22 -33.95 72.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.627 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -77.76 -37.95 47.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.957 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.49 -48.47 81.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.075 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.526 HG23 HD13 ' A' ' 104' ' ' LEU . 21.3 mm -73.28 -48.23 43.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.075 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.415 ' HD2' HG11 ' B' ' 98' ' ' VAL . 7.3 ttpt -54.84 -38.59 67.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.74 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -83.35 -38.83 21.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.966 0.412 . . . . 0.0 111.749 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.5 m -70.33 -40.25 74.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.446 -179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' ' 48' ' ' LEU . 4.3 mp -62.0 -56.49 18.49 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.9 pt20 -52.98 -27.83 20.95 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.438 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -61.54 -34.03 74.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.164 0.507 . . . . 0.0 109.743 179.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.802 HD12 ' O ' ' A' ' 103' ' ' THR . 3.4 mp -81.72 -37.86 15.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.409 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 1.024 HD11 HD13 ' A' ' 48' ' ' LEU . 16.3 mt -58.0 -53.73 41.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.501 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.4 m -52.05 -25.04 7.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.549 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 14.7 mtp-105 -59.16 -30.96 68.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 1.9 m-85 -94.97 -29.99 14.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.886 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -53.21 60.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.89 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.23 -31.72 71.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.31 -61.16 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.886 -179.966 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . 0.401 ' CE1' ' OD2' ' B' ' 91' ' ' ASP . 30.3 p90 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.771 0.32 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . 0.401 ' OD2' ' CE1' ' B' ' 90' ' ' TYR . 10.4 m-20 -67.17 -31.51 71.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 13.2 p -63.77 -37.91 89.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.925 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -77.32 -31.12 54.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.953 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.93 -31.46 72.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.442 ' CE1' ' CE ' ' A' ' 59' ' ' MET . 13.2 m-85 -142.41 134.92 27.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.858 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -102.89 168.62 9.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.004 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -96.07 162.06 13.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.914 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.557 HG22 ' HB3' ' A' ' 48' ' ' LEU . 35.6 m -108.43 115.13 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.68 133.04 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.876 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -78.06 -170.71 2.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -158.0 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -147.25 156.0 42.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 110.921 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 60.91 156.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.126 -179.96 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 N--CA 1.488 1.174 0 CA-C-O 120.806 0.252 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -104.1 -54.58 2.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.878 ' HA ' HG21 ' A' ' 103' ' ' THR . 6.0 m80 -98.35 38.72 1.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.913 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.9 p 179.26 130.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.051 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.411 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -147.65 160.04 28.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.724 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 104.75 3.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.985 0.422 . . . . 0.0 110.58 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.757 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -111.04 151.4 28.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.45 -179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.79 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.7 mm -101.31 145.28 11.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.874 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 10.5 t80 -141.49 136.98 31.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.585 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.6 mm-40 51.48 29.22 5.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.134 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 82.73 -1.83 1.32 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.671 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 8.5 p -105.89 133.4 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.79 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.5 m -73.93 157.06 36.94 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.022 0.439 . . . . 0.0 110.94 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.534 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -168.25 -151.3 7.02 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.979 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -134.75 120.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.865 0.364 . . . . 0.0 110.919 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.757 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.5 OUTLIER -96.65 122.92 48.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.25 132.8 28.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.599 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -87.48 122.78 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.5 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.48 93.6 9.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.741 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -94.91 24.81 4.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.993 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -103.23 -8.19 20.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.9 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 m -103.82 -176.0 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.91 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.591 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.59 -67.23 1.05 Allowed Pre-proline 0 C--N 1.331 -0.22 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.305 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.591 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 51.8 Cg_endo -90.43 109.54 0.37 Allowed 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.405 2.07 . . . . 0.0 111.094 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.635 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 116.22 1.71 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.023 0.44 . . . . 0.0 111.047 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -110.8 166.01 11.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.077 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -116.91 110.08 17.87 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.077 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -103.41 113.77 27.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.464 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.9 t90 -89.6 110.45 21.31 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.308 178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ttm180 -108.43 114.63 28.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.018 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.5 p -46.76 163.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.272 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -41.23 63.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.481 0.658 . . . . 0.0 109.809 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -83.57 -34.81 25.11 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.056 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.08 25.34 6.79 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.424 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.07 -18.41 14.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.647 0.26 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.755 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -127.56 139.93 52.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.773 0.32 . . . . 0.0 111.074 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.42 16.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 21.8 t60 -159.23 146.67 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.701 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.5 m -130.77 131.97 45.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 111.301 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.675 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.3 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.818 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.9 t -100.9 105.02 17.05 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.109 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -53.35 -24.56 12.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.11 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 3.3 t -59.85 -32.14 70.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.441 . . . . 0.0 110.728 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.43 -32.57 12.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.245 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.675 HD11 HG13 ' A' ' 40' ' ' VAL . 28.9 mm -47.99 98.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.213 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -57.73 -31.0 66.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.911 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.7 pttt -173.91 171.09 3.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.72 HD12 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -135.46 162.79 31.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' N ' HD22 ' A' ' 48' ' ' LEU . 35.9 mt-30 -133.73 160.77 36.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.952 0.406 . . . . 0.0 111.36 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.56 132.02 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 p -88.08 99.42 1.36 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.092 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -48.18 163.64 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.377 2.718 . . . . 0.0 112.284 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -17.29 8.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.511 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.08 -20.86 62.31 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.796 0.331 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.82 128.91 37.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.73 -26.87 68.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.061 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -100.17 115.36 29.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.695 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.8 mtp -92.68 105.83 17.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.913 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CZ ' ' B' ' 95' ' ' PHE . 7.7 mtm -155.47 139.39 16.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.68 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.2 mp -108.07 161.84 14.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.747 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -136.86 147.4 46.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -128.06 111.74 13.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.989 -179.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.57 HD13 ' CB ' ' A' ' 86' ' ' ARG . 48.0 mm -87.32 132.19 33.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.937 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.27 166.77 16.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.534 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -68.36 138.83 55.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 110.843 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.684 HG13 ' H ' ' A' ' 67' ' ' ASP . 14.3 p -108.73 -124.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.034 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.684 ' H ' HG13 ' A' ' 66' ' ' VAL . 7.2 t70 -173.71 149.59 1.62 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.888 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -128.63 42.32 3.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.66 36.73 2.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -137.15 -66.65 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? 60.63 111.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.0 179.39 6.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.917 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.6 mmtp -76.37 -167.71 0.83 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.425 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 21.1 t0 -120.68 50.92 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.163 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.6 OUTLIER 81.22 -52.9 0.29 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.181 0.515 . . . . 0.0 111.805 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -93.09 -43.59 8.8 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.95 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.35 27.89 0.04 OUTLIER Glycine 0 C--N 1.317 -0.505 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.668 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.64 112.72 24.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.862 0.363 . . . . 0.0 110.756 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -56.26 92.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.934 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.6 m -134.59 -173.77 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.035 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.2 t -118.72 139.05 26.6 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.24 124.47 15.72 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.44 2.094 . . . . 0.0 112.302 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 147.17 82.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.44 130.66 12.02 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.703 2.269 . . . . 0.0 112.456 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -57.21 114.5 2.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.519 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.57 ' CB ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.58 153.87 46.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.275 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.471 ' CD2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 -110.6 116.75 31.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.483 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.24 110.07 19.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -103.73 160.59 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.513 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 8' ' ' ILE . 9.2 t -130.46 134.92 47.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.019 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.68 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 5.5 m-85 -115.07 159.5 20.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.766 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -115.88 -20.97 9.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.635 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.886 ' HB3' HG12 ' A' ' 96' ' ' VAL . 7.0 t30 -107.45 -179.54 3.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.885 0.374 . . . . 0.0 111.055 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -26.37 10.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.01 -39.94 20.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.75 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.886 HG12 ' HB3' ' A' ' 93' ' ' ASN . 12.1 p -68.93 -32.13 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.991 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.511 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -76.38 -35.54 58.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.292 0.568 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -25.27 62.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.644 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -75.32 -49.39 19.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.934 0.397 . . . . 0.0 110.586 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.602 ' CG2' HD13 ' A' ' 104' ' ' LEU . 31.1 mm -63.29 -46.53 95.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.162 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -57.18 -41.8 79.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.331 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.8 mtt -83.5 -24.22 31.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.614 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.878 HG21 ' HA ' ' A' ' 3' ' ' HIS . 98.2 m -84.77 -35.71 22.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.216 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.602 HD13 ' CG2' ' A' ' 100' ' ' ILE . 4.1 mp -62.75 -60.05 4.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -50.9 -28.18 9.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.396 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -62.54 -35.11 78.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.813 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 103' ' ' THR . 2.8 mp -83.04 -39.47 15.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.567 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 48' ' ' LEU . 4.1 mt -56.79 -51.75 63.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.624 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.6 t -53.55 -24.4 13.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.414 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 25' ' ' ALA . 75.8 mtp180 -59.28 -30.95 68.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.791 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -99.01 -36.38 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.893 -179.848 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -60.35 -50.59 73.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.901 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -60.37 -31.73 70.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.67 -34.58 60.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.128 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.863 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.794 0.331 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.62 -51.01 9.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.904 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -78.11 -31.26 49.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.9 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.45 29.06 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.86 -63.01 1.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.922 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.448 ' CZ ' ' CE ' ' A' ' 59' ' ' MET . 54.8 m-85 -84.66 137.55 33.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.861 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -93.92 157.13 16.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.014 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -95.94 162.05 13.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.943 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.543 HG23 HD11 ' A' ' 48' ' ' LEU . 34.2 m -107.21 116.87 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.03 162.41 38.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.39 118.43 6.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.948 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.66 -62.69 0.38 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 62.83 -79.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.739 0.304 . . . . 0.0 111.025 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -154.11 -74.4 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.963 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 27.6 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.041 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.485 1.027 0 CA-C-O 120.989 0.329 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 t -70.04 -68.87 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.892 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.89 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -86.53 53.89 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.163 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 128.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.987 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -148.09 157.01 27.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.818 -0.705 . . . . 0.0 111.756 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 103.52 2.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.933 0.397 . . . . 0.0 110.687 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.756 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -107.57 167.03 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.401 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.438 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.4 mt -119.98 145.19 26.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.167 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.813 ' O ' HG12 ' A' ' 12' ' ' VAL . 38.9 t80 -144.57 141.9 29.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 26.5 mt-10 50.95 28.07 3.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.073 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 8.8 mttt 83.11 -3.79 1.25 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.821 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.813 HG12 ' O ' ' A' ' 9' ' ' PHE . 12.2 p -103.17 132.49 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.7 p -82.8 144.37 30.19 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.006 0.432 . . . . 0.0 110.948 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.564 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -151.89 -140.32 3.11 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.156 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.1 mm -137.83 120.64 19.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.756 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.77 123.29 49.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.013 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.17 132.66 30.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.942 0.401 . . . . 0.0 111.637 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.783 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -92.11 117.49 35.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.204 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -81.3 98.01 7.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.512 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -89.89 16.33 8.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.397 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -89.84 -14.34 34.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.856 0.36 . . . . 0.0 110.49 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 26' ' ' GLU . 27.7 m -92.94 -166.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.429 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -92.78 -61.62 0.19 Allowed Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.629 -179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 74.3 Cg_endo -78.48 3.59 7.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.461 2.108 . . . . 0.0 113.644 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 54.15 115.76 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.38 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -110.84 159.86 17.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.144 -179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.1 tt -116.69 110.25 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.2 m -104.53 116.23 31.72 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 61.7 t90 -89.51 110.45 21.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.161 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HA ' HG23 ' A' ' 37' ' ' VAL . 10.3 ttm-85 -108.85 115.48 30.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.38 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -46.94 166.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 111.17 -179.536 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -41.0 64.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.405 0.621 . . . . 0.0 109.663 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -87.13 -36.11 18.27 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.004 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.0 20.91 8.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.398 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -92.82 -18.17 23.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.694 0.283 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.711 ' HE2' HG11 ' A' ' 12' ' ' VAL . 12.8 mtpt -136.97 142.4 42.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.984 0.421 . . . . 0.0 111.202 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -143.61 157.48 16.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.035 -179.639 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 6.3 t60 -152.82 146.83 25.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.617 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.42 129.43 47.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 111.393 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.811 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -122.68 132.59 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.613 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.517 HG22 ' HG2' ' A' ' 26' ' ' GLU . 76.3 t -100.78 106.18 18.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.076 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -53.19 -25.27 13.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.409 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 5.4 t -67.35 -28.95 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 0.0 111.032 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.63 -31.69 14.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.243 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.811 HD11 HG13 ' A' ' 40' ' ' VAL . 17.6 mm -46.06 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.46 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.566 ' HB3' HG22 ' A' ' 63' ' ' ILE . 68.0 t0 -58.32 -48.32 80.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.938 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -153.71 161.15 42.38 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.059 0.457 . . . . 0.0 110.997 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 62' ' ' LEU . 16.2 tp -109.0 156.6 19.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.999 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 3.0 mt-30 -141.97 143.78 33.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.912 0.386 . . . . 0.0 111.265 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -153.53 134.39 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.739 HG22 ' O ' ' B' ' 94' ' ' GLU . 0.7 OUTLIER -57.34 149.2 49.83 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.218 0.532 . . . . 0.0 111.169 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -84.97 164.32 11.64 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.882 3.055 . . . . 0.0 112.222 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.2 -6.66 4.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.153 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -90.92 -21.47 21.35 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.764 0.316 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 48.0 t -84.28 129.48 34.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.44 -24.92 60.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.104 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 51' ' ' THR . 14.2 mmmt -102.28 114.39 28.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.49 118.31 21.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.8 mtm -148.78 139.31 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.056 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.903 HD13 ' CD1' ' A' ' 91' ' ' PHE . 7.4 mp -119.16 139.45 51.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.448 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 14.5 mtp180 -114.26 145.86 41.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.561 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.86 106.75 9.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.564 -179.233 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 46' ' ' ASP . 45.8 mm -87.27 137.36 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.335 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.502 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -107.75 -164.55 21.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.75 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.76 131.04 57.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.891 0.377 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.934 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -86.99 -5.4 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 122.261 1.029 . . . . 0.0 110.7 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 42.21 29.9 0.17 Allowed 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.619 -1.628 . . . . 0.0 112.062 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 40.97 31.77 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.02 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.6 t -138.45 26.13 2.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.201 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -130.57 24.37 5.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.258 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.34 150.14 35.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.772 0.32 . . . . 0.0 110.786 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.4 ' CD ' ' HG3' ' A' ' 82' ' ' PRO . 6.9 ppt_? -178.73 169.18 1.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.938 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -62.32 160.78 12.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -100.86 29.86 4.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.06 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 76.21 -0.15 3.16 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.798 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -105.93 -30.29 9.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.092 0.472 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.13 32.64 0.97 Allowed Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.575 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' HG13 ' A' ' 80' ' ' VAL . 14.1 m-80 -139.62 104.73 4.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.28 106.79 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.002 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 78' ' ' ASN . 22.4 m -118.63 -175.09 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.8 t -106.24 77.06 0.42 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.727 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.49 ' O ' HG21 ' A' ' 66' ' ' VAL . 6.8 Cg_endo -49.65 138.94 31.9 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.831 2.354 . . . . 0.0 112.562 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.408 ' CB ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -55.52 166.94 0.84 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.006 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.934 ' HA ' HG23 ' A' ' 66' ' ' VAL . 35.3 Cg_endo -63.41 167.68 12.6 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.679 2.253 . . . . 0.0 112.175 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.99 114.98 4.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.353 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.3 mtm180 -104.25 115.85 31.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.303 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.543 ' CD2' HG22 ' A' ' 40' ' ' VAL . 37.3 m-70 -103.18 111.17 23.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.22 110.08 19.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.183 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -107.87 133.86 51.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.533 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -110.97 117.42 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.13 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.903 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.1 m-85 -94.62 158.29 15.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.717 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -125.35 36.66 4.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.508 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.539 ' HB3' HG12 ' A' ' 96' ' ' VAL . 8.5 t30 -176.56 154.65 1.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.937 0.399 . . . . 0.0 111.023 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -33.26 42.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.013 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.82 -35.19 60.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.164 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.728 HG13 ' HD2' ' A' ' 91' ' ' PHE . 10.6 p -70.76 -30.45 42.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.275 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.465 ' HA ' ' CD2' ' A' ' 91' ' ' PHE . 18.9 ptm -75.68 -34.32 60.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.225 0.536 . . . . 0.0 110.325 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.03 -28.0 66.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -75.77 -53.07 9.08 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.607 HD12 ' CG2' ' A' ' 16' ' ' ILE . 26.2 mm -68.26 -45.56 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.102 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' HD21 ' A' ' 48' ' ' LEU . 9.0 ttpp -56.06 -40.71 73.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.416 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.7 ptm -83.41 -47.09 11.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.45 . . . . 0.0 111.567 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.89 HG21 ' HA ' ' A' ' 3' ' ' HIS . 90.7 m -55.64 -47.12 77.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.189 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.712 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.3 mp -57.94 -53.33 59.44 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.406 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.06 -37.62 34.23 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.877 179.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -58.38 -30.86 67.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.12 0.486 . . . . 0.0 109.988 179.296 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.783 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mt -84.66 -37.26 12.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.262 178.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.5 mt -58.9 -51.85 67.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.352 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.8 m -54.06 -23.3 13.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.577 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -56.21 -34.51 66.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.0 110.942 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 0.2 OUTLIER -95.34 -30.44 13.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.904 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 12.2 ttpp -58.73 -44.18 90.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.979 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -31.21 69.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.08 -34.38 16.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.162 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.948 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.731 0.301 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -89.67 -31.71 17.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 3.8 m -87.23 -31.34 20.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.858 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -98.42 28.99 3.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.739 ' O ' HG22 ' A' ' 51' ' ' THR . 12.7 pt-20 -88.3 -33.71 17.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.873 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.18 137.64 40.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.844 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.91 166.64 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.969 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -96.01 161.97 13.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.016 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.466 HG12 ' N ' ' B' ' 99' ' ' THR . 4.8 t -137.91 163.45 29.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.466 ' N ' HG12 ' B' ' 98' ' ' VAL . 11.0 t -47.46 127.86 11.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.185 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -136.26 -54.38 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.907 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -156.72 108.03 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -60.49 145.64 47.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.845 0.355 . . . . 0.0 110.92 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -169.66 164.48 10.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.114 179.968 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.487 1.141 0 CA-C-O 120.841 0.267 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -116.77 -52.5 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.908 ' HA ' HG21 ' A' ' 103' ' ' THR . 9.2 m80 -105.65 38.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 p 179.14 132.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.517 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -148.75 157.11 27.15 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.961 -0.638 . . . . 0.0 111.623 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.456 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.4 107.45 4.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.989 0.423 . . . . 0.0 110.704 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.768 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.75 159.1 19.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.303 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.575 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -108.87 143.52 18.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.263 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.865 ' O ' HG12 ' A' ' 12' ' ' VAL . 22.6 t80 -145.46 123.53 12.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.711 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 2.2 mt-10 68.12 30.86 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.874 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER 82.27 -5.21 1.42 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.935 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.3 p -104.8 137.57 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-O 120.789 0.328 . . . . 0.0 110.816 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.8 p -88.04 135.01 33.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.019 0.438 . . . . 0.0 110.855 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.497 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -139.63 -143.66 4.42 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.246 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.497 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.2 mm -133.45 120.61 39.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.997 0.427 . . . . 0.0 110.809 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.768 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -97.9 122.5 49.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.138 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.6 132.67 27.9 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.968 0.413 . . . . 0.0 111.372 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.561 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -85.22 126.11 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -93.58 93.14 7.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.687 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.95 25.12 4.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -103.42 -8.18 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.88 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.7 -176.08 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.874 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -65.38 -67.42 1.02 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.6 Cg_endo -90.4 109.61 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.418 2.079 . . . . 0.0 110.939 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.533 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.81 113.01 0.75 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.999 0.428 . . . . 0.0 111.185 -179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -110.87 166.36 11.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.97 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HG12 ' A' ' 16' ' ' ILE . 3.8 tt -116.82 109.97 17.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.7 m -98.64 112.54 24.56 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.442 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 56.9 t90 -89.51 110.56 21.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.168 178.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.0 mtm180 -110.86 115.67 29.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.307 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 63.7 m -46.89 168.97 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.836 0.35 . . . . 0.0 111.214 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -39.88 75.41 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.57 0.7 . . . . 0.0 109.459 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -93.37 -35.98 12.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.089 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 111.25 15.46 10.54 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.441 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.04 -17.98 54.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.618 0.247 . . . . 0.0 111.131 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.442 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -140.24 142.76 35.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.046 0.45 . . . . 0.0 111.375 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.79 128.4 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.919 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -136.29 122.15 19.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.885 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.24 146.79 28.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 111.374 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -131.39 136.29 57.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.708 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 93.6 t -100.72 104.26 15.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.106 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.401 ' N ' HD22 ' A' ' 42' ' ' LEU . 3.9 mm? -53.51 -23.48 10.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.182 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 3.4 t -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 111.006 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -94.36 -33.26 13.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.507 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.0 mm -45.34 104.52 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.224 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.84 -32.47 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.331 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HE3' HG21 ' A' ' 63' ' ' ILE . 4.2 pttt -171.73 159.15 5.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.053 0.454 . . . . 0.0 111.291 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -108.91 153.96 22.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.234 179.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.601 HE22 HD11 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -132.44 136.36 46.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.889 0.376 . . . . 0.0 111.111 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.72 134.76 23.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.469 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 8.9 p -44.59 99.59 0.21 Allowed Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.597 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.8 Cg_endo -48.72 163.65 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 123.455 2.77 . . . . 0.0 112.208 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.83 -18.37 12.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.402 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -81.84 -21.37 37.63 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.738 0.304 . . . . 0.0 111.187 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -86.82 136.95 32.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -89.36 -19.53 25.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.203 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.4 ' N ' ' CE ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -83.79 167.15 17.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.86 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.1 mtp -122.5 105.77 10.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.72 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.33 139.52 10.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.853 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.848 HD11 ' HG3' ' A' ' 97' ' ' MET . 6.5 mp -120.92 139.22 53.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.01 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -114.28 153.79 29.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.465 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -125.84 112.43 16.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.13 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.601 HD11 HE22 ' A' ' 49' ' ' GLN . 51.0 mm -87.43 134.9 26.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.87 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.06 173.6 22.54 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.669 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.22 138.34 33.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.07 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.913 HG23 ' HA ' ' A' ' 84' ' ' PRO . 1.2 t -104.15 -8.16 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 CA-C-O 122.073 0.94 . . . . 0.0 111.276 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 62.93 131.82 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.715 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -97.76 28.55 3.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.974 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 m -110.56 -19.39 12.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.29 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -94.47 -77.56 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.034 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt 61.8 151.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.24 169.9 3.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -84.84 -174.64 5.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.928 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -97.14 23.38 7.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.129 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.9 m120 71.45 -0.26 3.2 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.016 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -110.25 -33.77 6.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.22 0.533 . . . . 0.0 110.673 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.38 39.79 0.16 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.529 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.498 ' O ' HG13 ' A' ' 80' ' ' VAL . 1.5 t-20 -139.35 100.88 4.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.356 . . . . 0.0 110.891 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -59.55 108.49 0.73 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.913 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 78' ' ' ASN . 18.0 m -128.13 -176.03 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.149 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.6 t -105.14 115.88 61.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.734 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.877 ' O ' HG21 ' A' ' 66' ' ' VAL . 82.2 Cg_exo -44.41 145.16 2.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.582 2.188 . . . . 0.0 112.647 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.11 137.03 95.6 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.913 ' HA ' HG23 ' A' ' 66' ' ' VAL . 73.4 Cg_endo -74.11 128.19 12.0 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.604 2.203 . . . . 0.0 112.472 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -58.19 115.0 2.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.379 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.0 ptt85 -129.08 160.56 32.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.128 0.489 . . . . 0.0 111.618 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 12.3 m-70 -125.43 128.85 48.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.304 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.2 110.14 19.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.303 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -111.76 130.65 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.202 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 t -108.5 132.03 54.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.951 0.405 . . . . 0.0 110.893 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.757 ' CD1' HD13 ' A' ' 60' ' ' LEU . 4.7 m-85 -102.27 148.4 25.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.884 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -109.49 -21.52 12.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.284 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.804 ' HB3' HG12 ' A' ' 96' ' ' VAL . 1.7 t30 -114.44 154.25 28.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.912 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -81.07 -42.0 21.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -51.4 69.32 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.248 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.804 HG12 ' HB3' ' A' ' 93' ' ' ASN . 10.5 p -58.6 -30.3 41.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.947 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.848 ' HG3' HD11 ' A' ' 60' ' ' LEU . 16.1 ttp -71.6 -36.97 70.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.074 0.464 . . . . 0.0 110.586 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.27 -29.18 67.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.901 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -74.55 -54.63 7.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.043 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.605 HG23 HD13 ' A' ' 104' ' ' LEU . 33.4 mm -60.67 -50.89 78.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.251 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp -51.39 -45.73 62.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.883 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -83.39 -37.75 22.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.978 0.418 . . . . 0.0 111.884 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.908 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.6 m -67.86 -47.94 67.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.583 -179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.605 HD13 HG23 ' A' ' 100' ' ' ILE . 7.5 mp -60.2 -55.68 30.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -53.19 -28.51 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.43 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -61.8 -32.61 72.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.223 0.535 . . . . 0.0 109.674 179.149 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.561 ' CD1' HG21 ' A' ' 18' ' ' ILE . 2.8 mp -85.14 -37.26 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.53 178.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.6 mt -58.71 -60.71 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.508 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.9 t -56.11 -22.63 29.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.351 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.403 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -55.71 -49.12 73.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.035 0.445 . . . . 0.0 110.629 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 3.0 m-85 -72.59 -26.82 61.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.543 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.9 -67.32 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.075 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -37.71 88.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.915 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.55 -36.09 82.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.12 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.4 t0 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.883 179.986 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.824 0.345 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.29 -67.95 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -96.96 -63.76 1.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.842 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.96 -66.81 0.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -120.04 -42.12 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.901 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 51' ' ' THR . 3.8 t80 -168.97 170.56 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.814 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.92 146.24 24.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.056 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -91.4 162.07 14.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.572 HG23 ' HA ' ' A' ' 49' ' ' GLN . 34.4 t -128.94 103.96 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.094 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.01 101.99 3.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -156.81 -50.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.61 64.84 3.65 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.487 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.6 t30 59.94 84.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.811 0.339 . . . . 0.0 110.94 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 64.86 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.872 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.099 -179.983 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.895 0.29 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -108.91 -29.7 8.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.974 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.954 ' HA ' HG21 ' A' ' 103' ' ' THR . 2.5 p-80 -161.2 48.56 0.22 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.933 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.4 p -179.4 130.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.009 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -149.12 157.74 27.38 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.78 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.45 102.04 2.57 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.952 0.406 . . . . 0.0 110.662 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.758 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -105.66 170.61 7.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.309 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.3 mt -120.04 145.23 26.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.787 ' O ' HG12 ' A' ' 12' ' ' VAL . 32.8 t80 -145.81 141.55 28.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.303 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 23.3 mt-10 51.47 28.77 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.955 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER 82.3 -3.73 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.828 179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.787 HG12 ' O ' ' A' ' 9' ' ' PHE . 11.3 p -103.98 135.07 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-O 120.823 0.344 . . . . 0.0 110.714 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.86 131.17 34.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.021 0.439 . . . . 0.0 111.071 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -136.06 -136.17 3.52 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.096 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.9 mm -138.78 120.66 17.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 110.852 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.758 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.72 123.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.125 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.97 133.32 28.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.925 0.393 . . . . 0.0 111.595 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.585 HG21 HD11 ' A' ' 107' ' ' ILE . 5.0 mp -88.27 122.15 39.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.186 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -88.27 101.77 14.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.599 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -90.61 16.38 9.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.268 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -89.65 -15.56 32.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.267 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' H ' ' A' ' 25' ' ' ALA . 31.0 m -87.34 -164.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.466 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -96.93 -53.92 0.21 Allowed Pre-proline 0 C--N 1.33 -0.241 0 C-N-CA 121.295 -0.162 . . . . 0.0 111.344 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 7.3 Cg_endo -88.24 9.05 3.85 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.876 2.384 . . . . 0.0 113.055 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.588 ' H ' HG23 ' A' ' 22' ' ' VAL . . . 53.52 114.78 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.247 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' HG21 ' A' ' 22' ' ' VAL . 29.2 mt-10 -110.63 163.78 13.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 1.9 tt -116.75 110.24 18.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.14 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.8 m -103.36 117.05 33.59 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 38' ' ' HIS . 63.2 t90 -89.56 110.36 21.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.203 178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.86 114.03 27.68 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.21 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 82.9 p -47.05 165.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.187 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.81 -41.69 59.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.446 0.641 . . . . 0.0 109.923 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -79.99 -37.26 34.6 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.961 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.76 25.68 6.76 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.361 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -104.74 -18.03 14.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.605 0.241 . . . . 0.0 111.205 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.719 ' CE ' HG11 ' A' ' 12' ' ' VAL . 2.5 mtpm? -129.15 142.07 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.866 0.365 . . . . 0.0 111.129 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.47 16.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.175 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 4.7 t60 -155.17 146.74 23.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.701 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.6 m -126.52 133.77 51.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.012 0.434 . . . . 0.0 111.295 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.73 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -127.34 132.13 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.545 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 26' ' ' GLU . 78.0 t -100.81 104.2 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.973 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 108' ' ' ILE . 4.0 mm? -51.53 -24.6 5.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.493 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -67.72 -31.66 71.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.394 . . . . 0.0 111.052 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.414 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.5 p -90.06 -32.13 16.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.309 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.73 HD11 HG13 ' A' ' 40' ' ' VAL . 26.2 mm -46.37 104.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -56.89 -32.27 65.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.937 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' HG3' HG13 ' A' ' 63' ' ' ILE . 1.5 ptpt -175.86 167.82 3.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.015 0.436 . . . . 0.0 111.099 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.6 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.86 162.53 14.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.334 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 14.2 mt-30 -145.35 131.48 19.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -138.99 145.53 39.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.102 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -77.65 102.27 0.86 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.094 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.525 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.0 Cg_endo -47.09 163.62 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 123.433 2.756 . . . . 0.0 112.334 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.72 -14.12 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.407 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 t -86.26 -18.49 31.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.752 0.31 . . . . 0.0 111.2 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.95 133.5 41.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -71.6 -31.4 66.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.891 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.468 ' O ' HG21 ' A' ' 51' ' ' THR . 18.0 mmmt -102.5 140.17 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.721 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.4 mtp -101.55 105.94 16.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.803 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.4 ' O ' ' CZ ' ' B' ' 95' ' ' PHE . 18.4 mtm -154.97 139.56 16.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.021 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.4 mp -113.37 141.45 47.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.749 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 9.5 mtm180 -115.79 152.99 32.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.023 0.44 . . . . 0.0 111.158 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.509 ' HG ' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.98 117.47 21.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.156 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.7 mm -87.16 156.71 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.488 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -121.77 162.66 15.45 Favored Glycine 0 CA--C 1.517 0.161 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.251 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.3 tptp -60.65 139.56 57.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 110.637 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.7 HG13 ' H ' ' A' ' 67' ' ' ASP . 13.7 p -106.29 -124.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.147 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG13 ' A' ' 66' ' ' VAL . 4.9 t0 -179.4 145.6 0.25 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -109.49 -20.62 12.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.168 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 p -61.01 -20.11 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.209 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.16 91.24 2.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -82.96 -174.71 5.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.944 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.78 169.86 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.934 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -93.62 -172.31 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -109.37 27.56 9.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.962 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 72.24 0.01 3.42 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.887 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -106.83 -30.3 8.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.642 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.96 31.95 1.14 Allowed Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -126.39 122.75 36.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 110.877 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.92 125.55 24.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.876 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.1 m -150.73 -174.14 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.405 HG13 ' HD2' ' A' ' 82' ' ' PRO . 22.4 t -100.74 136.63 19.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.013 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' O ' HG21 ' A' ' 66' ' ' VAL . 9.0 Cg_endo -50.95 138.85 42.47 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.719 2.279 . . . . 0.0 112.322 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.32 117.52 50.46 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.892 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 57.1 Cg_endo -69.92 -178.31 2.34 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.571 2.18 . . . . 0.0 112.454 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -81.12 115.08 20.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.384 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -107.48 116.7 32.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.436 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -93.23 116.95 29.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.187 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.29 110.14 20.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.45 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -111.85 130.56 55.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.144 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.4 ' O ' HG13 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -105.22 129.16 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.919 0.39 . . . . 0.0 111.302 -179.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.592 ' HZ ' HG21 ' A' ' 100' ' ' ILE . 5.2 m-85 -106.76 134.5 49.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.618 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -96.73 -20.42 18.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.502 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB2' HG12 ' A' ' 96' ' ' VAL . 1.9 m-80 -119.98 151.53 38.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -80.35 -35.82 34.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.832 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -62.63 -52.61 62.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.731 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.704 HG12 ' HB2' ' A' ' 93' ' ' ASN . 13.7 p -58.83 -29.69 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 12.6 ttp -71.1 -39.14 72.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.19 0.519 . . . . 0.0 110.54 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.59 -29.62 69.71 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.708 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -78.42 -53.9 6.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 28.0 mm -58.86 -50.1 80.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.3 ttpp -59.44 -42.81 92.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.382 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 22.2 mtm -79.82 -24.5 41.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.565 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.954 HG21 ' HA ' ' A' ' 3' ' ' HIS . 96.5 m -84.76 -41.41 16.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.109 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.717 HD11 ' CD1' ' A' ' 27' ' ' LEU . 5.1 mp -61.28 -57.33 12.82 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.575 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 3.5 pt20 -53.42 -27.54 25.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.384 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.1 mm-40 -62.89 -35.82 81.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.264 0.554 . . . . 0.0 109.835 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 103' ' ' THR . 2.5 mp -78.42 -35.51 19.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.515 178.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD11 HD12 ' A' ' 42' ' ' LEU . 35.6 mm -56.6 -54.68 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.637 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -51.58 -25.16 6.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.649 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -57.13 -28.44 62.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.6 m-85 -92.28 -29.86 16.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.99 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -69.83 -63.06 1.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -60.24 -31.67 70.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.2 -61.35 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.113 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.5 t0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.879 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.31 -40.11 89.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.38 -32.43 71.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.935 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 28.98 7.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -119.9 25.03 10.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.106 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.434 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -168.93 134.98 1.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.871 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.37 164.54 27.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -95.99 161.83 13.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.937 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.533 ' O ' HG13 ' B' ' 98' ' ' VAL . 10.8 p -141.65 115.39 4.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.025 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . 0.445 HG22 ' H ' ' B' ' 100' ' ' ASP . 0.2 OUTLIER -145.73 178.92 7.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.914 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.445 ' H ' HG22 ' B' ' 99' ' ' THR . 1.4 m-20 -132.87 172.42 12.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.927 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 159.1 -103.35 0.23 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.557 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 60.54 34.84 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.944 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.07 -61.46 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.157 -0.925 . . . . 0.0 111.073 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.179 0 CA-C-O 120.859 0.275 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -103.26 -48.35 4.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.803 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.9 m80 -98.03 37.87 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.908 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.1 p -178.48 131.04 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.13 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.32 158.13 27.62 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.617 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 108.44 4.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.011 0.434 . . . . 0.0 110.626 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.783 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -117.14 150.36 38.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.489 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 13' ' ' SER . 3.4 mm -100.11 145.24 11.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.716 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.892 ' O ' HG12 ' A' ' 12' ' ' VAL . 25.5 t80 -140.27 115.31 9.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.853 0.358 . . . . 0.0 111.008 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER 69.03 32.74 3.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.14 179.893 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 2.0 mtpt 82.94 -5.45 1.27 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.979 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -104.2 131.7 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 CA-C-O 121.014 0.435 . . . . 0.0 110.627 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.781 ' HA ' HD12 ' A' ' 8' ' ' ILE . 53.8 p -74.05 158.73 33.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.048 0.452 . . . . 0.0 110.968 -179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -169.3 -151.78 7.47 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.135 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 14' ' ' GLY . 6.0 mm -134.42 120.55 33.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.971 0.415 . . . . 0.0 110.884 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.783 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -95.54 121.84 46.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.6 135.75 33.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.531 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.7 mp -89.36 125.98 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.609 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -91.71 92.74 8.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.794 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -94.56 25.48 3.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.97 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -102.91 -8.81 20.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -102.52 -176.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.843 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.562 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.79 -66.53 1.31 Allowed Pre-proline 0 C--N 1.33 -0.25 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.562 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 44.4 Cg_endo -90.95 109.57 0.33 Allowed 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.399 2.066 . . . . 0.0 110.954 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -48.9 115.72 1.38 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.973 0.416 . . . . 0.0 111.13 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.6 mt-10 -110.89 164.77 12.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.905 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.719 ' CD1' HD11 ' A' ' 104' ' ' LEU . 2.6 tt -116.81 110.15 18.01 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.7 m -101.99 112.75 25.5 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.6 t90 -89.39 110.39 21.2 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.965 178.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' O ' ' N ' ' A' ' 15' ' ' ILE . 21.8 mtt180 -108.63 116.2 31.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.351 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 1.9 t -46.84 165.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -40.67 66.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.445 0.64 . . . . 0.0 109.582 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -89.21 -35.66 16.08 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.95 21.73 7.28 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -93.64 -18.86 21.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.695 0.283 . . . . 0.0 111.134 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HD2' HG11 ' A' ' 12' ' ' VAL . 5.7 mttp -133.46 141.5 47.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.93 0.395 . . . . 0.0 111.105 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.6 157.4 16.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.16 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 7.1 t60 -158.6 146.91 18.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.751 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 129.65 40.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.9 0.381 . . . . 0.0 111.321 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.852 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -120.62 135.66 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.49 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.75 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG22 ' CD ' ' A' ' 26' ' ' GLU . 82.9 t -100.82 101.53 12.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.115 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 104' ' ' LEU . 3.9 mm? -51.87 -25.83 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.162 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.431 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 15.9 m -63.31 -29.32 70.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -97.25 -31.89 12.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.451 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.852 HD11 HG13 ' A' ' 40' ' ' VAL . 21.6 mm -46.17 104.96 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -57.78 -47.58 82.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.191 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -155.77 171.08 20.62 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.945 0.403 . . . . 0.0 111.069 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.87 HD21 ' HA ' ' A' ' 101' ' ' LYS . 13.5 tp -111.72 155.13 23.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.087 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' N ' ' HG ' ' A' ' 48' ' ' LEU . 5.3 mt-30 -135.94 131.44 35.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.893 0.378 . . . . 0.0 111.194 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.492 ' HB2' ' HG3' ' A' ' 101' ' ' LYS . . . -140.5 138.01 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 59' ' ' MET . 12.0 p -84.94 99.57 0.89 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.134 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -48.2 163.67 0.23 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.401 2.734 . . . . 0.0 112.295 179.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.66 -13.89 26.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.471 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -71.24 -21.52 62.1 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.741 0.305 . . . . 0.0 111.212 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.0 t -92.59 129.24 38.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -59.26 -28.29 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.94 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -95.43 159.53 14.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.658 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' MET . 2.7 mtp -130.13 105.69 8.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.165 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.51 ' O ' HG23 ' A' ' 51' ' ' THR . 0.2 OUTLIER -151.45 139.58 20.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.796 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 7.8 mp -112.55 137.85 50.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.728 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.427 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 5.8 mtp180 -114.39 153.74 29.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.906 0.384 . . . . 0.0 111.062 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.03 113.4 15.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.275 -179.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 47.3 mm -87.39 136.75 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.551 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -103.66 171.29 19.99 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.725 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.69 141.89 53.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.734 0.302 . . . . 0.0 110.742 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.726 HG13 ' H ' ' A' ' 67' ' ' ASP . 14.9 p -106.81 -124.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.153 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.726 ' H ' HG13 ' A' ' 66' ' ' VAL . 9.2 t0 -164.52 107.68 0.9 Allowed 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.819 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.12 -21.05 58.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.257 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.2 p -95.84 42.69 1.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.866 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -151.37 31.27 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.46 148.67 47.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.46 -174.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.969 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.8 mmtt -107.65 -169.64 1.56 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -115.16 26.1 10.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.069 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 75.88 -0.38 3.18 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.722 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.44 -30.75 8.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.101 0.477 . . . . 0.0 110.618 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 120.27 31.21 1.31 Allowed Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.444 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.477 ' O ' HG13 ' A' ' 80' ' ' VAL . 16.7 m120 -124.06 115.59 21.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.875 0.369 . . . . 0.0 110.842 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -59.69 115.37 3.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.6 m -128.82 -174.02 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.7 t -119.28 139.02 27.01 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.955 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.31 127.14 21.18 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.495 2.13 . . . . 0.0 112.247 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 109.24 1.68 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 57.1 Cg_endo -69.84 -176.86 1.65 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.605 2.203 . . . . 0.0 112.375 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -73.65 114.8 12.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -108.13 114.9 29.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.478 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.596 ' CD2' HG22 ' A' ' 40' ' ' VAL . 84.9 m-70 -93.36 111.25 22.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.049 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.3 110.06 19.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.528 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CE2' ' HB3' ' A' ' 87' ' ' HIS . 81.0 m-85 -117.81 134.87 54.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.016 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.421 ' O ' HG12 ' A' ' 8' ' ' ILE . 10.1 t -111.29 133.41 53.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.916 0.388 . . . . 0.0 111.179 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.8 m-85 -112.8 152.47 29.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.707 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -108.64 -26.65 10.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.694 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.595 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.9 m-20 -107.19 163.65 12.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.029 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.52 -38.79 12.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.066 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.95 -52.13 21.69 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.595 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.0 p -55.33 -47.13 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.506 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -64.64 -34.35 78.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.252 0.549 . . . . 0.0 110.008 179.267 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -33.48 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.394 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -68.28 -48.09 65.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.639 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.572 HG23 HD13 ' A' ' 104' ' ' LEU . 38.7 mm -62.56 -49.73 82.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.87 ' HA ' HD21 ' A' ' 48' ' ' LEU . 3.0 ttpt -53.35 -41.14 65.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.548 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.4 ptp -83.56 -38.71 21.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.994 0.426 . . . . 0.0 111.494 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.803 HG21 ' HA ' ' A' ' 3' ' ' HIS . 89.7 m -68.68 -42.26 78.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.384 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.719 HD11 ' CD1' ' A' ' 27' ' ' LEU . 6.7 mp -61.73 -58.34 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -51.97 -28.62 17.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.3 mm-40 -62.04 -33.61 74.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.265 0.555 . . . . 0.0 109.621 179.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' A' ' 18' ' ' ILE . 4.3 mt -85.32 -37.33 12.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.7 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -57.84 -59.09 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.517 179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.0 t -55.35 -23.31 23.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.349 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.411 ' CG ' ' N ' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -56.84 -49.84 74.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.029 0.442 . . . . 0.0 110.614 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 107' ' ' ILE . 2.9 m-85 -73.04 -26.25 61.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.606 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -67.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.158 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.55 -31.6 69.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.898 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.47 -33.72 71.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.942 179.928 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -79.86 -30.68 40.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -59.43 -29.25 67.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -58.94 -55.71 31.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -84.26 -63.11 1.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.89 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -72.88 135.07 45.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.822 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -118.63 141.45 48.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.0 162.05 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.852 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -126.01 108.14 18.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.147 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.05 -176.26 5.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -116.59 81.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -137.45 -88.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.466 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 3.4 t30 60.71 172.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -167.48 146.23 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.924 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.232 -0.89 . . . . 0.0 111.098 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.815 0.256 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -105.65 -30.82 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.534 ' HA ' HG21 ' A' ' 103' ' ' THR . 10.2 p-80 -149.34 47.5 0.97 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.831 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.0 p -177.33 130.18 0.16 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -150.05 158.77 27.81 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.882 -0.675 . . . . 0.0 111.68 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.42 108.88 5.07 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.862 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.744 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -115.85 151.01 36.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.217 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.685 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.3 mp -98.06 145.12 10.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.029 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.87 ' O ' HG12 ' A' ' 12' ' ' VAL . 11.3 t80 -148.49 125.95 11.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.525 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.08 32.18 8.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.689 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.97 -3.9 1.95 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.099 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.884 HG11 ' HD3' ' A' ' 36' ' ' LYS . 9.5 p -106.42 145.17 14.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.835 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.685 ' HA ' HG13 ' A' ' 8' ' ' ILE . 49.5 p -93.96 128.09 40.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.983 0.42 . . . . 0.0 111.147 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.37 -141.81 4.76 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.129 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -135.59 120.59 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.96 0.41 . . . . 0.0 110.849 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.744 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.36 122.02 47.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.97 130.38 27.08 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.464 -178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.58 HG21 HD11 ' A' ' 107' ' ' ILE . 5.3 mp -81.42 126.53 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.427 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -88.66 92.85 9.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.12 26.22 4.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -105.36 -7.48 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.916 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 m -105.09 -176.52 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.946 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.589 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.76 -67.65 0.99 Allowed Pre-proline 0 C--N 1.33 -0.244 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.589 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 53.5 Cg_endo -89.64 109.66 0.44 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.411 2.074 . . . . 0.0 110.932 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.719 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.86 118.74 2.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.147 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 24.6 mt-10 -110.74 172.05 7.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.243 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.499 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -122.92 109.95 14.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.237 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.9 m -105.58 118.21 35.99 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.8 t90 -92.82 110.59 22.04 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.457 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 17.3 mtp85 -109.39 114.9 28.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.176 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 5.0 p -46.99 166.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.154 -179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -41.64 57.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.459 0.647 . . . . 0.0 110.02 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -82.03 -37.17 26.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.246 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.12 25.88 5.95 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.39 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -105.22 -18.88 13.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.613 0.244 . . . . 0.0 111.334 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.884 ' HD3' HG11 ' A' ' 12' ' ' VAL . 1.9 mttm -128.69 139.51 52.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.073 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.49 16.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.367 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -156.27 146.71 21.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.538 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.43 132.37 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.985 0.422 . . . . 0.0 111.405 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.867 HG13 HD11 ' A' ' 45' ' ' ILE . 2.4 t -127.43 130.36 70.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.627 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 87.6 t -100.82 106.84 20.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.141 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 42' ' ' LEU . 3.6 mm? -51.11 -25.26 4.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.311 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 1.6 t -64.93 -29.96 70.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.955 0.407 . . . . 0.0 111.014 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -95.37 -33.37 12.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.867 HD11 HG13 ' A' ' 40' ' ' VAL . 25.5 mm -46.97 108.73 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.22 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -58.78 -51.21 70.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.951 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -156.11 171.02 20.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.002 0.43 . . . . 0.0 110.966 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.076 HD13 HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -109.0 162.64 14.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.047 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -144.02 136.43 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.403 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -149.08 131.33 15.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.055 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.625 HG21 ' O ' ' A' ' 57' ' ' LYS . 2.8 p -57.87 103.38 0.36 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.197 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.5 Cg_endo -48.39 163.72 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.334 2.689 . . . . 0.0 112.295 179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.75 -18.32 12.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.383 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -74.77 -21.43 59.33 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.765 0.317 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.9 t -102.11 108.64 20.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.919 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -59.1 -21.34 59.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.143 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.625 ' O ' HG21 ' A' ' 51' ' ' THR . 11.3 mmmt -84.04 115.1 22.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.85 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' SD ' ' A' ' 97' ' ' MET . 1.4 mtp -80.87 117.04 21.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.832 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.531 ' HE2' ' CE1' ' B' ' 95' ' ' PHE . 1.4 mtp -159.45 139.61 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 97' ' ' MET . 1.7 mp -123.25 140.55 52.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.927 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HG2' ' HE3' ' A' ' 88' ' ' MET . 12.6 mtp180 -119.42 151.59 38.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.766 179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.539 HD11 HG21 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -128.05 111.76 13.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.458 -179.48 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 49.9 mm -87.35 136.18 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.839 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.32 164.58 19.18 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.683 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 142.25 58.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.805 0.336 . . . . 0.0 110.928 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.821 HG21 ' O ' ' A' ' 82' ' ' PRO . 13.0 p -107.0 -124.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.994 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.694 ' H ' HG13 ' A' ' 66' ' ' VAL . 3.0 p30 -176.7 141.93 0.4 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.916 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -106.59 -21.34 13.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.138 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.7 m -75.68 -21.1 57.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.178 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -110.77 63.34 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.902 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -81.93 -179.5 7.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.96 169.11 2.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.924 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -83.63 -177.75 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -122.37 29.47 6.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t30 76.53 -0.41 3.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.69 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.69 -29.96 9.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.148 0.499 . . . . 0.0 110.688 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.53 26.76 3.03 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.531 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 80' ' ' VAL . 73.4 m-20 -127.3 115.54 19.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.06 98.44 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 78' ' ' ASN . 26.5 m -98.22 -174.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.7 t -113.1 125.88 29.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.046 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.821 ' O ' HG21 ' A' ' 66' ' ' VAL . 50.7 Cg_exo -53.26 126.48 21.77 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.466 2.11 . . . . 0.0 112.232 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -59.42 139.93 88.63 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.12 167.92 25.03 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.584 2.189 . . . . 0.0 112.477 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.18 175.95 0.37 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.535 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB3' ' CD1' ' A' ' 63' ' ' ILE . 7.5 ptt180 -166.97 109.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.861 0.362 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -93.03 122.24 35.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.336 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.443 ' HE3' ' HG2' ' A' ' 61' ' ' ARG . 2.3 tpt -87.26 110.15 20.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.403 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -118.73 130.56 55.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.501 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 8' ' ' ILE . 48.2 t -114.8 114.97 26.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.073 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 5.3 m-85 -97.98 134.52 40.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -98.18 29.52 3.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.56 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.3 m120 -155.67 150.68 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.715 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -35.43 24.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.077 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.73 -38.82 64.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.477 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.56 HG12 ' CB ' ' A' ' 93' ' ' ASN . 7.1 p -58.92 -51.45 72.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.193 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.9 -32.58 74.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.183 0.516 . . . . 0.0 110.218 179.425 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.59 -34.16 75.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.645 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -80.99 -26.47 36.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.745 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.496 HG22 HD22 ' A' ' 104' ' ' LEU . 1.3 mm -86.24 -49.44 15.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.58 ' HG2' HG21 ' B' ' 98' ' ' VAL . 5.0 tmmm? -56.48 -30.09 62.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.119 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.9 ptm -83.39 -37.89 22.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.193 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 107' ' ' ILE . 88.8 m -76.86 -33.43 57.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.601 ' CD2' HD21 ' A' ' 48' ' ' LEU . 4.6 mp -64.54 -59.62 4.09 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 108' ' ' ILE . 3.6 pt20 -53.18 -26.46 17.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.314 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.83 -34.8 78.07 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.242 0.544 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.719 HG23 ' HB3' ' A' ' 25' ' ' ALA . 2.8 mp -80.86 -37.58 16.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.533 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 1.076 HD11 HD13 ' A' ' 48' ' ' LEU . 17.3 mt -57.36 -54.83 25.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.491 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -50.97 -25.66 4.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.483 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -59.14 -30.7 68.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.866 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 2.7 m-85 -93.84 -33.75 13.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -64.17 1.04 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.966 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.51 -39.41 64.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.136 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.915 179.966 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.761 0.315 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -60.35 -31.77 70.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.5 t -98.17 3.96 49.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.415 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -98.69 29.06 3.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 111.02 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.09 -56.24 5.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.867 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.531 ' CE1' ' HE2' ' A' ' 59' ' ' MET . 3.2 m-85 -82.35 135.01 35.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.785 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -108.93 159.24 16.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.045 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -96.03 161.98 13.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.938 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.58 HG21 ' HG2' ' A' ' 101' ' ' LYS . 35.9 m -121.65 111.91 32.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 157.12 43.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.925 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -109.9 -48.14 3.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.893 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 72.45 143.2 0.47 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.486 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -139.88 107.21 5.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -107.97 141.32 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.915 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.151 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.488 1.176 0 CA-C-O 120.839 0.266 . . . . 0.0 111.768 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -67.57 -39.89 84.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.912 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.758 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -92.39 46.79 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.141 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.3 p -175.41 129.16 0.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' HG23 ' A' ' 96' ' ' VAL . . . -149.38 156.49 26.82 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.674 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.36 105.41 3.51 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.0 0.429 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.753 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.31 160.91 16.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.3 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.59 HG23 ' C ' ' A' ' 12' ' ' VAL . 1.2 mt -110.38 142.92 21.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.24 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.867 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.6 t80 -145.08 123.3 12.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.735 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' A' ' 11' ' ' LYS . 1.0 OUTLIER 68.71 31.31 4.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.803 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 10' ' ' GLU . 0.7 OUTLIER 81.47 -4.62 1.61 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.994 179.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.867 HG12 ' O ' ' A' ' 9' ' ' PHE . 9.1 p -105.26 139.22 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 p -90.58 130.8 36.57 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.954 0.407 . . . . 0.0 111.032 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.72 -140.23 4.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.104 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.3 mm -136.12 120.45 25.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.88 0.371 . . . . 0.0 110.855 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.753 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.49 122.67 49.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.076 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -139.14 134.03 32.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.455 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.788 HG21 HD11 ' A' ' 107' ' ' ILE . 4.9 mp -89.86 120.56 38.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -81.78 92.87 6.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.652 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -96.32 25.17 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.94 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -104.86 -6.4 20.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.964 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 m -105.36 -176.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.598 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -64.92 -67.2 1.1 Allowed Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.256 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.598 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 54.2 Cg_endo -90.24 109.94 0.4 Allowed 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.391 2.06 . . . . 0.0 110.838 178.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -48.16 120.21 3.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.0 0.429 . . . . 0.0 111.116 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -110.77 171.97 7.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.226 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.739 HD12 HG13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -127.84 109.88 12.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.193 179.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.1 m -106.88 116.22 31.54 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 36' ' ' LYS . 59.0 t90 -89.61 110.45 21.32 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.218 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.7 ttt180 -109.5 114.49 28.18 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.247 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.7 p -47.03 164.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.856 0.36 . . . . 0.0 111.205 -179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -41.1 61.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.467 0.651 . . . . 0.0 109.913 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -82.61 -36.33 26.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.236 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.77 26.27 5.9 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.372 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.44 -18.85 13.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.669 0.271 . . . . 0.0 111.365 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.847 ' CD ' HG11 ' A' ' 12' ' ' VAL . 6.3 mttp -127.11 138.94 53.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.0 111.051 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.59 157.36 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.297 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 29' ' ' TRP . 19.4 t60 -157.88 146.74 19.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.4 m -128.82 133.61 48.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.598 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.952 HG13 HD11 ' A' ' 45' ' ' ILE . 2.3 t -128.67 129.21 68.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.474 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 86.6 t -100.63 100.41 10.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 C-N-CA 120.111 -0.635 . . . . 0.0 111.175 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 104' ' ' LEU . 3.1 mm? -47.61 -26.94 1.64 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.255 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.43 ' HA ' ' CE1' ' A' ' 111' ' ' TYR . 3.2 t -59.45 -31.17 69.07 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.029 0.443 . . . . 0.0 110.65 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 p -96.04 -36.1 11.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.205 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.952 HD11 HG13 ' A' ' 40' ' ' VAL . 33.8 mm -48.05 103.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.112 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -53.0 -35.97 59.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.085 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -173.1 -179.75 2.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.968 0.413 . . . . 0.0 110.937 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.451 HD13 ' H ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -139.87 158.39 44.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.442 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.72 169.55 17.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.986 0.422 . . . . 0.0 111.643 -179.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 52' ' ' PRO . . . -161.56 132.16 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.883 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.492 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -54.13 102.55 0.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.359 -179.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.6 Cg_endo -48.51 163.66 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 123.359 2.706 . . . . 0.0 112.264 178.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.41 -14.34 27.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.426 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.39 -21.45 45.67 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.731 0.301 . . . . 0.0 111.257 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.9 m -95.52 127.19 41.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.903 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.96 63.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.421 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -83.82 140.27 32.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.827 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.4 mmm -108.72 105.97 15.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.901 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.456 ' C ' HD12 ' A' ' 60' ' ' LEU . 27.4 mtm -156.87 139.47 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.999 HD22 ' CZ ' ' A' ' 91' ' ' PHE . 10.6 mp -114.97 144.64 43.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.922 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.433 ' HG3' ' CZ ' ' B' ' 95' ' ' PHE . 4.6 mtm180 -114.38 148.22 37.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.586 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -127.96 117.97 22.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 45' ' ' ILE . 37.3 mm -87.22 156.71 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.609 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.473 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -125.01 158.17 19.43 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.357 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 138.49 58.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 110.453 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 67' ' ' ASP . 12.2 p -105.02 -123.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.131 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.682 ' H ' HG13 ' A' ' 66' ' ' VAL . 6.1 t0 -179.94 104.09 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.899 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -98.34 27.86 4.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.0 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.34 -20.11 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.266 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -91.18 -64.48 1.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.943 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.08 105.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.09 172.56 12.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.943 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -81.01 -176.63 6.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.22 31.28 5.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.7 m120 72.98 0.08 3.56 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.923 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.78 -29.02 11.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.089 0.471 . . . . 0.0 110.606 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.73 28.72 1.84 Allowed Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.514 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.489 ' O ' HG13 ' A' ' 80' ' ' VAL . 29.2 m-80 -133.9 111.84 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.8 112.09 1.51 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.969 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.489 HG13 ' O ' ' A' ' 78' ' ' ASN . 27.3 m -128.16 -174.25 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -116.75 103.39 52.46 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.84 124.61 10.13 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.471 2.114 . . . . 0.0 112.369 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.01 147.89 89.35 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.005 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 58.6 Cg_endo -70.76 -172.78 0.73 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.668 2.246 . . . . 0.0 112.368 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -86.88 115.06 24.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.613 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HG3' HD13 ' A' ' 63' ' ' ILE . 7.1 ttt180 -107.44 109.46 21.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.268 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -94.14 114.04 26.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.417 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.19 110.16 19.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.256 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.71 130.66 56.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.428 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 8' ' ' ILE . 10.1 t -105.17 120.06 40.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.024 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.999 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 3.6 m-85 -90.71 134.54 34.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -102.14 27.07 6.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.364 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 96' ' ' VAL . 1.7 t30 -169.32 153.3 5.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.897 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -81.14 -38.31 27.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.777 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -44.8 94.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.215 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.745 HG13 ' HD2' ' A' ' 91' ' ' PHE . 12.8 p -58.95 -27.17 34.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.062 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.4 ttp -70.26 -41.44 73.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.219 0.533 . . . . 0.0 110.668 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.98 -27.82 69.09 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.873 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -80.19 -38.27 31.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.533 HG21 ' HZ ' ' A' ' 91' ' ' PHE . 18.4 mm -86.2 -57.61 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.259 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.05 -36.56 8.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.422 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.2 mmm -83.38 -58.89 2.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.052 0.453 . . . . 0.0 111.296 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 3' ' ' HIS . 99.7 m -52.09 -35.45 47.79 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.229 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.794 ' CD1' HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.67 -60.15 3.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.196 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.577 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -50.59 -33.87 23.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.579 179.05 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -60.66 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.17 179.362 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.788 HD11 HG21 ' A' ' 18' ' ' ILE . 5.9 mt -82.05 -36.46 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.616 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.794 HD11 ' CD1' ' A' ' 104' ' ' LEU . 38.6 mm -53.49 -59.59 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.898 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.1 -26.57 2.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.813 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -57.69 -26.76 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 43' ' ' SER . 1.8 m-85 -104.83 25.54 10.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt -134.0 -66.11 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -31.84 72.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.86 -52.87 31.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.928 -179.988 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.341 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -90.2 15.04 11.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 1.6 m -98.62 -31.34 11.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.81 0.338 . . . . 0.0 110.919 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.67 -60.13 4.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.05 -49.79 40.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.955 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.433 ' CZ ' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -101.1 135.09 43.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.881 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -139.9 138.07 35.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.911 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -74.88 155.12 37.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.9 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.592 HG23 ' O ' ' B' ' 98' ' ' VAL . 27.1 m -135.43 109.18 10.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.08 126.14 12.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.9 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -100.8 -169.94 1.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -171.43 -103.87 0.17 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.472 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -174.65 79.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.81 0.338 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.16 142.28 31.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.067 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.487 1.129 0 CA-C-O 120.914 0.298 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -67.79 -67.21 0.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.966 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.914 ' HA ' HG21 ' A' ' 103' ' ' THR . 0.0 OUTLIER -89.3 50.62 1.96 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.1 -179.962 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -177.83 129.41 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -149.17 155.56 26.39 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.7 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.43 105.37 3.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.023 0.439 . . . . 0.0 110.672 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.73 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -110.67 153.48 25.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.207 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.691 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -103.97 145.26 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.038 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.835 ' O ' HG12 ' A' ' 12' ' ' VAL . 70.9 t80 -146.93 138.75 24.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.333 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 56.15 28.86 13.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.841 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mttt 81.64 -3.44 1.6 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.87 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.835 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.2 p -105.17 142.23 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.784 0.326 . . . . 0.0 110.831 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.691 ' HA ' HG13 ' A' ' 8' ' ' ILE . 32.1 p -91.41 133.41 35.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 110.963 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -137.84 -139.3 3.85 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.162 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.1 mm -138.65 120.52 17.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.336 . . . . 0.0 110.855 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.73 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -96.92 122.51 48.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.135 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.44 130.73 28.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.425 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 27' ' ' LEU . 5.1 mp -84.51 124.03 39.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.603 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.39 92.92 8.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.63 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -95.32 25.89 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.924 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.81 -8.36 19.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.2 m -102.98 -176.19 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.84 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.592 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -64.94 -67.88 0.93 Allowed Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.242 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.592 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 48.6 Cg_endo -90.6 109.7 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.377 2.052 . . . . 0.0 110.904 178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.35 114.76 1.01 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.912 0.387 . . . . 0.0 111.222 -179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.41 ' CD ' HG22 ' A' ' 41' ' ' VAL . 15.5 mt-10 -110.9 164.23 13.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.806 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG23 ' A' ' 16' ' ' ILE . 1.4 tt -116.82 110.05 17.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.9 m -100.65 115.46 30.26 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.4 t90 -89.45 110.44 21.26 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.467 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' ILE . 65.4 mtp180 -108.18 113.92 27.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.213 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.457 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.6 p -46.92 164.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.825 0.345 . . . . 0.0 111.119 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -40.93 64.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.524 0.678 . . . . 0.0 109.825 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.69 -40.61 28.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.126 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.47 26.37 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.314 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -104.96 -18.73 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.19 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.723 ' CE ' HG11 ' A' ' 12' ' ' VAL . 13.9 mtpt -128.65 143.78 51.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.897 0.38 . . . . 0.0 111.142 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.66 157.57 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.289 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -156.23 146.87 21.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.647 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 34.1 m -130.01 133.83 47.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.892 0.377 . . . . 0.0 111.407 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.731 HG13 HD11 ' A' ' 45' ' ' ILE . 2.7 t -126.17 134.43 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.749 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.41 HG22 ' CD ' ' A' ' 26' ' ' GLU . 77.5 t -101.0 102.94 14.15 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.096 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 HG13 ' A' ' 45' ' ' ILE . 3.7 mm? -52.69 -25.31 10.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.047 -179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.5 t -64.24 -30.05 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.986 0.422 . . . . 0.0 110.761 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -93.6 -33.42 13.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.345 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.731 HD11 HG13 ' A' ' 40' ' ' VAL . 25.4 mm -44.87 109.21 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.326 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -64.93 -33.42 75.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.213 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HG3' ' CG1' ' A' ' 63' ' ' ILE . 8.7 pttt -168.66 165.14 12.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.137 0.494 . . . . 0.0 111.474 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.706 HD21 ' CB ' ' A' ' 104' ' ' LEU . 0.2 OUTLIER -108.89 162.73 13.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.187 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HA ' HG23 ' B' ' 98' ' ' VAL . 4.5 mt-30 -144.33 136.36 26.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.864 0.364 . . . . 0.0 111.035 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.57 131.76 12.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.161 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.704 HG21 ' O ' ' A' ' 57' ' ' LYS . 1.2 p -58.07 103.6 0.37 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.5 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 9.4 Cg_endo -47.82 163.73 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 123.304 2.669 . . . . 0.0 112.358 179.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.43 -20.2 4.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.446 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.4 p -76.58 -21.29 55.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.8 m -92.8 115.28 27.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.13 -22.19 64.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.1 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.704 ' O ' HG21 ' A' ' 51' ' ' THR . 22.1 mmmt -88.6 114.8 25.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.884 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.7 106.24 9.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 13.2 mtm -150.01 139.62 21.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.501 HD21 ' HB2' ' A' ' 101' ' ' LYS . 6.9 mp -125.33 151.29 46.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.908 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' NE ' ' CD2' ' B' ' 95' ' ' PHE . 5.8 mtt180 -131.86 153.85 49.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.718 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' CD1' HG21 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -127.28 114.07 17.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.168 -179.498 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.5 mm -87.38 128.25 40.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.58 163.62 22.78 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.599 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.14 142.59 58.36 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.837 0.351 . . . . 0.0 110.809 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.719 HG11 ' CG1' ' A' ' 81' ' ' VAL . 12.1 p -104.86 -123.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 CA-C-O 120.984 0.421 . . . . 0.0 110.054 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.688 ' H ' HG13 ' A' ' 66' ' ' VAL . 1.4 m-20 -145.62 101.8 3.61 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.877 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -59.31 -21.01 59.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.22 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.09 35.04 1.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.93 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.5 mmtt -150.71 35.7 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.93 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mmtt -71.34 143.8 50.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -176.29 168.68 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.922 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -71.54 176.46 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.899 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -108.18 28.46 8.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 76.08 -0.16 3.18 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.658 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -105.06 -29.81 10.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.115 0.484 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 119.57 29.62 1.69 Allowed Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.574 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.49 ' O ' HG13 ' A' ' 80' ' ' VAL . 70.6 m-80 -132.3 113.39 13.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.831 0.348 . . . . 0.0 110.887 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 103.35 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 78' ' ' ASN . 25.8 m -123.79 -174.58 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.719 ' CG1' HG11 ' A' ' 66' ' ' VAL . 19.3 t -104.73 138.77 19.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.94 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' A' ' 81' ' ' VAL . 77.8 Cg_exo -50.16 138.5 36.52 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.413 2.075 . . . . 0.0 112.312 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -46.73 104.83 0.43 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.283 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -74.13 140.88 28.65 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.549 2.166 . . . . 0.0 112.572 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -64.13 115.33 4.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.483 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HB3' HD13 ' A' ' 63' ' ' ILE . 17.5 ptt85 -124.69 174.87 7.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.219 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.429 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 26.3 m-70 -130.65 126.91 37.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.676 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -87.32 110.17 20.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.076 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.11 137.13 47.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.498 ' O ' HD12 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -120.17 118.9 31.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.035 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HD2' HG22 ' A' ' 96' ' ' VAL . 7.8 m-85 -97.22 178.26 5.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.885 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -142.56 43.66 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.636 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.639 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -176.69 159.89 1.89 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 0.0 110.969 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -77.77 -44.3 28.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.1 -43.33 67.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.437 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.639 HG12 ' CB ' ' A' ' 93' ' ' ASN . 13.7 p -58.97 -47.25 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.122 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.517 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -68.24 -34.46 76.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.205 0.526 . . . . 0.0 110.234 179.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -71.2 -29.93 65.76 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.808 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -65.18 -55.72 16.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.861 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.619 HG23 HD13 ' A' ' 104' ' ' LEU . 30.2 mm -67.14 -45.54 86.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.501 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -52.93 -44.4 67.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.711 -179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -83.52 -40.99 18.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.899 0.381 . . . . 0.0 111.794 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.914 HG21 ' HA ' ' A' ' 3' ' ' HIS . 76.5 m -60.67 -52.21 66.11 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.097 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.706 ' CB ' HD21 ' A' ' 48' ' ' LEU . 7.9 mp -55.14 -47.72 74.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.89 0.376 . . . . 0.0 110.058 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -50.78 -39.4 52.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.468 ' HA ' ' NE2' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -57.01 -31.39 65.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.088 0.47 . . . . 0.0 110.13 179.476 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.441 HG22 ' CE2' ' A' ' 111' ' ' TYR . 2.3 mp -82.8 -32.42 9.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.46 178.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.705 HD11 ' CD1' ' A' ' 48' ' ' LEU . 34.4 mm -59.1 -63.06 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.448 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.1 t -58.06 -22.67 51.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.193 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -38.85 81.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.595 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.3 m-85 -79.17 -31.1 43.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.552 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -70.98 -54.55 10.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.97 -31.49 68.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.953 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -80.63 -30.46 36.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.893 179.985 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.782 0.325 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -68.42 -30.94 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.64 -30.43 68.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.918 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.06 -30.73 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -76.77 -31.32 56.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.435 ' CD2' ' NE ' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -95.28 134.98 37.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -102.16 162.37 12.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.94 162.04 13.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.981 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.556 HG23 ' HA ' ' A' ' 49' ' ' GLN . 32.3 t -132.8 103.87 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.086 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.16 107.4 4.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.909 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.43 165.76 4.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . 109.62 -104.05 1.83 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.532 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 2.1 t30 60.68 166.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.852 0.358 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -132.73 123.03 25.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.161 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 120.823 0.259 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.03 -49.39 3.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.5 ' HA ' HG21 ' A' ' 103' ' ' THR . 15.3 m80 -97.88 38.44 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.2 p 178.75 134.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.156 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . -147.28 158.03 27.59 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -71.39 105.65 3.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 0.0 110.64 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.775 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -112.38 155.71 23.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.383 -179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.668 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.5 mp -106.28 145.27 14.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.838 ' O ' HG12 ' A' ' 12' ' ' VAL . 42.3 t80 -145.04 139.32 27.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 54.42 30.06 12.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.753 0.311 . . . . 0.0 110.94 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttt 81.19 -3.13 1.72 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.921 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.838 HG12 ' O ' ' A' ' 9' ' ' PHE . 10.7 p -105.85 139.65 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.668 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -86.08 142.54 28.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.945 0.402 . . . . 0.0 111.028 -179.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -150.26 -144.16 3.88 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.197 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 14' ' ' GLY . 5.8 mm -135.01 120.65 30.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 110.899 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.775 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -97.13 123.51 49.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.48 124.68 17.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.014 0.435 . . . . 0.0 111.567 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.785 HG21 ' CD1' ' A' ' 107' ' ' ILE . 4.6 mp -82.53 121.03 35.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.259 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.557 HD22 HG13 ' A' ' 22' ' ' VAL . 13.9 t30 -87.03 104.23 16.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.66 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -92.24 20.23 6.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.054 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -94.18 -15.78 24.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.022 0.439 . . . . 0.0 110.148 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.768 HG21 ' HG3' ' A' ' 26' ' ' GLU . 31.5 m -86.0 -165.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.46 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.469 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -94.64 -54.17 0.23 Allowed Pre-proline 0 C--N 1.33 -0.24 0 C-N-CA 121.19 -0.204 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 23' ' ' SER . 9.4 Cg_endo -89.09 9.25 3.61 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.954 2.436 . . . . 0.0 113.133 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . 54.35 113.79 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.956 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.768 ' HG3' HG21 ' A' ' 22' ' ' VAL . 24.9 mt-10 -110.6 164.3 12.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.167 0.508 . . . . 0.0 111.317 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' CD1' HD11 ' A' ' 104' ' ' LEU . 3.0 tt -116.77 110.13 18.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.32 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 m -102.36 112.19 24.8 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 59.5 t90 -89.41 110.5 21.3 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.423 ' O ' ' N ' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -109.69 115.67 30.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.264 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.455 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.3 OUTLIER -46.95 168.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.112 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.41 -41.0 63.85 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.476 0.655 . . . . 0.0 109.675 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -90.05 -35.35 15.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.107 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.32 19.69 8.28 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -89.59 -18.8 25.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.818 ' HD2' HG11 ' A' ' 12' ' ' VAL . 6.0 mttt -135.17 142.02 46.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.954 0.407 . . . . 0.0 111.149 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -143.7 157.44 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.101 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -157.74 146.79 19.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.21 107.2 8.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.896 0.379 . . . . 0.0 111.391 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 HD11 ' A' ' 45' ' ' ILE . 2.6 t -98.77 134.59 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.512 HG22 ' HG2' ' A' ' 26' ' ' GLU . 82.7 t -100.63 106.0 18.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.91 178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 27' ' ' LEU . 4.0 mm? -53.18 -26.6 17.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.489 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' CZ ' ' A' ' 111' ' ' TYR . 4.4 t -65.47 -27.5 68.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.92 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.44 HG23 ' HB ' ' A' ' 41' ' ' VAL . 1.3 p -93.77 -31.9 14.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.309 0.576 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.758 HD11 HG13 ' A' ' 40' ' ' VAL . 25.6 mm -49.11 107.62 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -34.5 77.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.165 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.77 162.97 14.12 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.046 0.45 . . . . 0.0 111.118 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.948 HD23 HG11 ' B' ' 98' ' ' VAL . 6.4 tp -108.89 153.66 23.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.156 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 30.7 mt-30 -133.58 137.37 45.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.022 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.22 134.8 17.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.211 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.534 HG23 ' O ' ' A' ' 59' ' ' MET . 39.4 p -84.31 99.57 0.83 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.037 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 10.1 Cg_endo -47.38 163.8 0.15 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.378 2.719 . . . . 0.0 112.353 179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.04 -18.1 4.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.483 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -71.29 -21.03 62.13 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.778 0.323 . . . . 0.0 111.1 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -94.33 117.69 30.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.811 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -58.25 -22.86 53.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -99.0 115.03 28.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.9 mtp -87.52 106.1 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.811 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.534 ' O ' HG23 ' A' ' 51' ' ' THR . 43.1 mtm -153.37 139.71 18.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.007 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' C ' ' A' ' 59' ' ' MET . 7.3 mp -119.54 138.46 53.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.857 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -114.36 153.34 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.067 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.83 HD13 HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -127.95 111.0 13.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.024 -179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.443 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 48.6 mm -87.27 130.99 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.55 167.08 25.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.566 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.02 140.33 52.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.827 0.346 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 67' ' ' ASP . 15.0 p -109.17 -125.15 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.156 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.682 ' H ' HG13 ' A' ' 66' ' ' VAL . 7.0 p-10 -178.38 -175.03 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.758 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -176.23 37.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.2 t -157.81 31.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -154.15 -49.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 60.24 164.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.891 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -134.41 -176.01 4.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -114.78 173.62 6.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -97.38 23.37 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.137 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 75.27 -0.63 3.24 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.775 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -110.7 -32.59 6.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.183 0.516 . . . . 0.0 110.755 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.25 -13.25 3.28 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.625 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -71.08 162.65 29.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.331 . . . . 0.0 110.888 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -106.09 131.99 52.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.918 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 23.9 m -151.99 -174.57 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.081 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.2 t -105.92 125.93 31.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.51 123.57 10.96 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.456 2.104 . . . . 0.0 112.458 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -60.29 150.74 71.07 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.765 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.95 122.87 7.5 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.606 2.204 . . . . 0.0 112.423 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -56.95 114.91 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -128.53 166.68 18.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -127.25 131.0 50.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.499 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.27 110.16 20.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -110.07 130.63 55.51 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.648 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 8' ' ' ILE . 6.6 p -112.05 123.25 49.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.955 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CD2' HG22 ' A' ' 96' ' ' VAL . 5.7 m-85 -100.52 161.1 13.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.3 m-20 -135.27 49.78 2.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.677 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.689 ' CB ' HG12 ' A' ' 96' ' ' VAL . 1.1 t30 -178.47 157.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.36 . . . . 0.0 110.924 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -75.74 -36.43 59.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.131 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.08 -44.58 25.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.911 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.689 HG12 ' CB ' ' A' ' 93' ' ' ASN . 14.8 p -58.58 -45.39 90.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.081 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.497 ' N ' HG13 ' A' ' 96' ' ' VAL . 4.3 ppp? -67.43 -35.85 80.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.21 0.529 . . . . 0.0 110.673 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.403 ' O ' ' HE2' ' A' ' 102' ' ' MET . 2.9 m-20 -74.02 -26.84 60.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.925 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -62.67 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.927 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.812 HG23 HD13 ' A' ' 104' ' ' LEU . 1.5 mp -57.3 -43.47 82.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.865 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.442 ' HA ' HD21 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -45.28 -56.93 4.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.463 -179.797 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.403 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 12.6 ptp -83.66 -41.76 17.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.009 0.433 . . . . 0.0 111.435 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.564 ' CG2' HD13 ' A' ' 18' ' ' ILE . 61.5 m -53.25 -63.82 1.02 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.812 HD13 HG23 ' A' ' 100' ' ' ILE . 7.0 mp -49.86 -43.58 49.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.86 -41.16 57.72 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.93 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -55.98 -30.65 62.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 110.043 179.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.785 ' CD1' HG21 ' A' ' 18' ' ' ILE . 3.2 mp -85.27 -37.23 11.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.393 178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 48' ' ' LEU . 11.1 mt -57.71 -61.5 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.111 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.0 t -56.46 -24.8 48.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.911 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.68 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 0.2 OUTLIER -52.09 -26.15 10.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.005 179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 43' ' ' SER . 8.3 m-85 -91.47 -31.59 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -73.62 -61.07 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.98 -38.64 83.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 110' ' ' ARG . . . -86.82 -68.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.106 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.4 t70 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.223 179.818 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.858 0.361 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -76.01 -32.35 59.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.896 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -63.82 -31.54 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.03 -32.24 73.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.04 -40.21 11.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.404 ' CZ ' ' O ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -88.64 134.99 33.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.832 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -137.04 166.02 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.907 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.02 162.02 13.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.948 HG11 HD23 ' A' ' 48' ' ' LEU . 7.8 p -132.96 107.3 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.04 102.01 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.858 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -81.18 102.87 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.856 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.3 -156.93 21.63 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.477 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -121.08 105.11 10.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.775 0.321 . . . . 0.0 110.881 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -84.11 159.41 21.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.06 179.979 . . . . . . . . 0 0 . 1 stop_ save_